condensation and sublimation of carbon dioxide and water

94
Scholars' Mine Scholars' Mine Doctoral Dissertations Student Theses and Dissertations 1972 Condensation and sublimation of carbon dioxide and water Condensation and sublimation of carbon dioxide and water molecules at cryogenic temperatures molecules at cryogenic temperatures Victor Cazcarra Follow this and additional works at: https://scholarsmine.mst.edu/doctoral_dissertations Part of the Chemistry Commons Department: Chemistry Department: Chemistry Recommended Citation Recommended Citation Cazcarra, Victor, "Condensation and sublimation of carbon dioxide and water molecules at cryogenic temperatures" (1972). Doctoral Dissertations. 213. https://scholarsmine.mst.edu/doctoral_dissertations/213 This thesis is brought to you by Scholars' Mine, a service of the Missouri S&T Library and Learning Resources. This work is protected by U. S. Copyright Law. Unauthorized use including reproduction for redistribution requires the permission of the copyright holder. For more information, please contact [email protected].

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Page 1: Condensation and sublimation of carbon dioxide and water

Scholars' Mine Scholars' Mine

Doctoral Dissertations Student Theses and Dissertations

1972

Condensation and sublimation of carbon dioxide and water Condensation and sublimation of carbon dioxide and water

molecules at cryogenic temperatures molecules at cryogenic temperatures

Victor Cazcarra

Follow this and additional works at: https://scholarsmine.mst.edu/doctoral_dissertations

Part of the Chemistry Commons

Department: Chemistry Department: Chemistry

Recommended Citation Recommended Citation Cazcarra, Victor, "Condensation and sublimation of carbon dioxide and water molecules at cryogenic temperatures" (1972). Doctoral Dissertations. 213. https://scholarsmine.mst.edu/doctoral_dissertations/213

This thesis is brought to you by Scholars' Mine, a service of the Missouri S&T Library and Learning Resources. This work is protected by U. S. Copyright Law. Unauthorized use including reproduction for redistribution requires the permission of the copyright holder. For more information, please contact [email protected].

Page 2: Condensation and sublimation of carbon dioxide and water

CONDENSATION AND SUBLIMATION

OF CARBON DIOXIDE AND WATER MOLECULES

AT CRYOGENIC TEMPERATURES

by

VICTOR CAZCARRA, 1945-

A DISSERTATION

Presented to the Faculty of the Graduate School of the

UNIVERSITY OF MISSOURI-ROLLA

~n Partial Fulfillment of the Requirements for the Degree

DOCTOR OF PHILOSOPHY

in

CHEMISTRY

1972

T2762 93 pages c.l

Page 3: Condensation and sublimation of carbon dioxide and water

ABSTRACT

Measurements of the condensation coefficient of co2 and H20 have

been made using a molecular beam and quartz crystal microbalances.

The dependence of the condensation coefficient on variables such

as population density on the substrate, temperature of the substrate,

molecular beam intensity and temperature of the molecular beam, was

investigated.

The results are explained using heterogeneous nucleation theory

ii

for low density population, and a new approach for high density popula-

tion is presented.

The rate of sublimation of these two gases was measured directly.

-9 The results are reported in terms of vapor pressure in the range 10

-4 to 10 Torr.

The spatial distribution of reflected and sublimated C02 and

H20 molecules is found to follow the diffuse cosine law.

Page 4: Condensation and sublimation of carbon dioxide and water

ACKNOWLEDGEMENTS

The author wishes to express his appreciation to Dr. L. Levenson,

Associate Professor of Physics and Senior Investigator at the Space

Sciences Research Center for suggesting the project and his advice,

help and encouragement throughout this investigation.

He also wishes to thank Dr. W. James, Professor of Chemistry

and Director of the Graduate Center for Materials Research for his

interest and advice.

A special note of recognition is due to C.E. Bryson III, whose

collaboration, experience and helpful advice made this study much

easier.

The financial assistance of the National Science Foundation in

the form of a research assistantship is gratefully acknowledged.

iii

Page 5: Condensation and sublimation of carbon dioxide and water

iv

TABLE OF CONTENTS

Page

ABS TRA.CT. • • • • • . • . • . • • • • • • • • • • • • • • . • • • • • . • . • . . . . . . • • . • • • . • • • . . • . • • • • • • ii

ACKN OWLEDGE}rfENTS ••••••••••••••••••••••••••••••••••••••••••••••••••••• iii

T.ABLE OF CONTENTS • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • i v

LIST OF FIGURES. • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • vi

LIST OF T.ABLES •••••••••••••••••••••••••••••••••••••••••••••••••••••• viii

N O~N CLATURE • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • ix

I. INTRODUCTION •••••••••••••••••••••••••••••••••••••••••••••••• 1

II. EXI?ERI~NT~ APPARATUS •••••••••••••••••••••••••••••••••••••• 3

A. Description •• . ......................................... . 3

B. Procedure ••..•••••••.•••.••••.••••••.•••••••••...••.•... 4

c. Gases Investigated. 11

III. RESULTS AND DISCUSSION •••••.•••••••••••.••.•••••••••.•.••••. 21

A. Low Cover ages. • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • . • 21

1. co2 Experiments .•••.•••••••••••••..••••••••••••••••• 21

2. H2o Experiments ••••••••••.•••.••••••.•.•••••••••••.• 23

3. Discussion ..•....•..•.•.............••....•••.••..•. 23

a. Nucleation Theory. 24

b. Interpretation of the Experimental Results .••••• 25

High Coverages. 30 B. . ....................................... . 1. co2 Experiments ...•.•.....••...•...•...•...•........ 30

2. H20 Experiments ••.•.••••••••••••••••••.••.•••••••••• 30

3. Discussion.......................................... 31

a. Increase in the S ublima. tion Rate. • • • • • • • • • • • • • • • 32

b. Partial Reflection of Molecules Not

Accomm.oda ted. • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • 32

Page 6: Condensation and sublimation of carbon dioxide and water

v

Page

C. Intermediate Coverages. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 33

1. co2 Experiments. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 33

2. H2 0 Experiments. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 34

3. Discussion. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 35

IV. VAPOR PRESSURE OF SOLID C02 AND H20 ••••••••••••••••••••.••••• 63

A. Introduction ............................................. 63

B. Experimental Apparatus and Procedure. . .................. . 63

C. Results and Discussion ••••••••••••••••••••••••••••••••••• 64

V. CONCLUSION................................................... 73

VI. APPENDIX A SPATIAL DISTRIBUTION OF C02 AND H20 MOLECULES

ON REFLECTION AND SUBLIMATION FROM A COLD SURFACE •••••••••••• 75

A. Introduction. . • . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . • . . . . . . . . 75

B.

c.

Expe rimen ta 1 . ......................•.........•.........•.

Results and Discussion ••••••••..••......•..••••••........

75

79

BIBLIOGRAPHY. • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • . • • • • • • • • • • • • • • • 81

VITA. • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • . • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • 84

Page 7: Condensation and sublimation of carbon dioxide and water

vi

LIST OF FIGURES

Figure Page

1. System 1 ........................................................ 13

2. System 2. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 14

3. Vacuum System ................................................... 15

4. Molecular Beam ............ ~ ..................................... 16

5. Bottom Plate of Vacuum Chamber .................................. 17

6. Procedure for Measurements . ..................................... 18

7. Change in Geometrical Factor with r .....•.•.•......•............ 19

8. Effect of co2 in Water on y ..................................... 20

9. Change in Frequency Recorded (1) .••....•........................ 45

10. Change in Frequency Recorded (2) ..•......•.........•.....•.•••.• 46

11. Reflection Coefficient of co2 Versus Time (1) (Clean Water

Substrate) . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4 7

12. Reflection Coefficient of co2 Versus Time (2) (Clean Water

Substrate) ...................................................... 48

13. Reflection Coefficient of co2 Versus Time (3) (Clean Water

Substrate) ...................................................... 49

14. Reflection Coefficient of co2 Versus Time (4) (Clean Water ·

Substrate)....... . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 50

15. Reflection Coefficient of C02 Versus Time (1) (Contaminated

Water Substrate)................................................ 51

16. Reflection Coefficient of co2 Versus Time (2) (Contaminated

Water Substrate) ................................................ 52

17. Reflection Coefficient of H2o Versus Time (Bare CB) ..•....•.•... 53

18. Reflection Coefficient of Water Versus Coverage................. 5·4

19. Dependence of the Surface Diffusion Coefficient on T5 ...••.•.••• 55

Page 8: Condensation and sublimation of carbon dioxide and water

vii

Figure Page

20. Reflection Coefficient of co2 Versus Impingement Rate

(TG = 152 °K) • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • • 56

21. Reflection Coefficient of C02 Versus Impingement Rate

(T = G

2 74°K) ....••.................•......................•.... 57

22. Reflection Coefficient of C02 Versus the Inverse of Ts . ........ 58

23. Reflection Coefficient of C02 Versus the Ratio of Fluxes R • •••. 59

24. Reflection Coefficient of C02 Versus Ratio of Fluxes for

Intermediate Coverages. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60

25. Reflection Coefficient of H20 Versus the Ratio of Fluxes R ••••• 61

26. Reflection Coefficient of H20 Versus T8 at Constant Flux

and Coverage. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 62

27. Vapor Pressure of co2 .......... ......................... · ... ·· · 71

28. Vapor Pressure of H20 ......................................... . 72

Page 9: Condensation and sublimation of carbon dioxide and water

viii

LIST OF TABLES

Table Page

I. Sticking Coefficient of co2 on Clean Water Substrate ••.•••••••• 36

II. Sticking Coefficient of co2 on Contaminated Water Substrate •.•• 39

III. Estimated Amount of co2 Adsorbed on H20 Substrate (at Maximum

(·1-y)) ••••••••••••••••••••••••••••••••••••••••••••••••••••••••• 40

IV. Condensation Coefficient of C02 at High Coverages ••.•••..••.••• 41

V. Condensation Coefficient of H20 at High Coverages •••••••••••••• 44

VI. Vapor Pressure of co2 •••••••••••.•.•••••••.•••••••••••••••••••• 66

VII. Vapor Pressure of H2o .....•.................................... 68

VIII. Constants A, B and HS for the Vapor Pressure Curves of C02

and H2o .•.• _..................................................... 70

Page 10: Condensation and sublimation of carbon dioxide and water

CB

CR

BM

f

f

y

1-y

R

NOMENCLATURE

Copper block

Copper block reflection microbalance

Beam monitor microbalance

Frequency of the quartz crystal microbalance (Hz)

Rate of change of frequency (Hz sec-1)

Condensation or sticking coefficient

Reflection coefficient

Molecular beam temperature (°K)

Copper block temperature (°K)

Impingment rate on CB (molecules cm-2 sec-1)

-2 -1 Sublimation rate from CB (molecules em sec )

The ratio ¢/¢8

ix

Page 11: Condensation and sublimation of carbon dioxide and water

1

I. INTRODUCTION

Gas-surface interactions are of great interest in many domains,

such as heteregeneous nucleation, catalysis, and high vacuum and space

technology. Unfortunately, these interactions are not well understood.

This work is mainly concerned with the interactions of molecules with

surfaces.

• When a gas molecule encounters a solid or a liquid surface, inter-

molecular forces between it and the bulk particles determine the out-

come of the collision. If the molecule retains or obtains enough thermal

energy during the collision process, it can overcome the attractive

forces and return to the gas phase. Loss of too much thermal energy

to the bulk will result in the retention of the molecule on the surface.

The average probability y that the molecule will remain on the

surface is simply the ratio of the number of molecules that are captur-

ed to the number that hit. When the substrate is composed of the same

species as the gas, y is called the condensation coefficient. If the

surface is made of foreign material, y is often called the sticking or

trapping coefficient. For a given gas, like C02 , measurements of y

have been reported by several investigators (1-6) . Values for y rang-

ing from 0.5 to 1.0 have been reported for apparently the same experi-

mental conditions.

The object of this study is partly to resolve these discrepancies

by carefully studying the effect of variables such as the temperature of

the substrate, coverage, flux, temperature of the impinging molecules

and nature of the substrate. A new apparatus combining a molecular beam

and quartz crystal microbalances {7,8) was built for this purpose.

Page 12: Condensation and sublimation of carbon dioxide and water

2

The work includes experimental results, and their discussion for:

C02 condensing on solid co2 ; co2 sticking on solid H20; and H20 condens­

ing on solid HzO. In the process of obtaining y, it was necessary to

measure the rate of sublimation of solidified films of C02 and H2o.

Equivalent vapor pressures of sublimating gas ranged from 10-9 to 2 x 10-4

Torr. These vapor pressure studies are reported in the second part of

this thesis.

All results are related to the spatial distribution of the molecules

leaving a surface. Therefore a special study of the spatial distribu-

tion ·of reflected and sublimated molecules was carried out and is

described in Appendix A.

Page 13: Condensation and sublimation of carbon dioxide and water

3

II. EXPERIMENTAL APPARATUS

A. Description

A molecular beam of gas, a copper target and several quartz crystal

microbalances (7,8) were used to measure y. These components were

mounted in a molecular beam chamber, shown schematically in Figs. 1 and

2. The chamber wall and the microbalances were held at about 55°K. The

chamber was pumped by a liquid nitrogen-trapped, oil diffusion pump to

-9 a base pressure of about 10 Torr.

The molecular beam nozzle was heated with a tin oxide resistor.

Its temperature TG was measured with a calibrated platinum resistor

thermometer. The nozzle was designed to give an effusive molecular

beam whose angular spatial distribution obeyed the cosine law (9).

The beam intensity was controlled by an automatic pressure control valve

(Fig. 3). The gas purity was checked by a monopole mass filter mounted

at the entrance of the nozzle tube (Fig. 4).

The copper block (CB) had a diameter of 2.54 em. It was mounted on

three nylon screws that provided thermal isolation (Fig. 5). Two

calibrated resistance thermometers, one germanium and the other platinum,

were imbedded in CB. These thermometers were used to measure T8 • A

tin oxide resistor was used to maintain T • Thermal contact between s

the resistors and the copper block was provided by a low temperature

varnish (General Electric 7031). Additional thermal contact was made

by clamping one lead of each thermometer to the block.

Three quartz crystal microbalances, CR, BM, and BR, were set up in the

chamber (Figs. 1 and 2). They were used to measure the impingement rates

of gas on their surfaces. These quartz crystals microbalances were AT

Page 14: Condensation and sublimation of carbon dioxide and water

4

cut plates with 8 = 40°10' and have been previously described (7,8). They

were driven at their fundamental resonance frequency of 5 MHz by three tem-

perature controlled oscillators. A Hewlett-Packard Model 5360A computer

counter and a Hewlett-Packard Model 5375A keyboard were used to measure 0 -1

either the frequency f(Hz) or the rate of change of frequency f(Hz sec ).

A digital to analog converter and a recording potentiometer served to

0

read either f or f.

B. Procedure

After the nozzle temperature TG and the copper block temperature

T8 became constant, the molecular beam was turned on. The temperatures

of the walls and the microbalances were low enough (55°K) so that the

condensation coefficients y of co2 and H20 were greater than 0.9999 on

these surfaces. Under these conditions only molecules reflected or

sublimated from the surface of the copper block could arrive in measur-

able numbers at the surfaces of CR and BR. Furthermore, molecules

arriving at CR and BR were condensed "in toto".

The microbalances CR and BR therefore provided a direct measurement

of the rate at which molecules were reflected from CB. (With CB and

BM both at 55°K, no reflected or evaporated molecules of co2 or H20

could be detected at either CR or BR. The lower limit of y ~ 0.9999 for

these gases at 55°K was derived from this observation). The micro-

balance BM gave a direct measurement of the molecular beam impingement

rate on its surface. When the molecular beam was on, the mean impinge-

. -2 -1 ment rate was nCB molecules em sec on the surface of CB.

At sufficiently high values of T8 , molecules sublime from the con­

densed thin film so that when the molecular beam was turned off, the

Page 15: Condensation and sublimation of carbon dioxide and water

5

intensity of sublimated gas arriving at microbalance CR was nSB molecules

-2 -1 em sec With the beam on (Fig. 6) the molecules hitting CB were

reflected with a probability 1-y. The intensity of the reflected

particles arriving at CR was k(l-y)nCB' where k was a constant deter­

mined by the spatial distribution of molecules leaving CB and by the

geometry. The combined reflected and sublimated molecules from CB

-2 -1 therefore gave the impingement rate nCR molecules em sec at the

microbalance CR, such that

. nCR = k(l-y)nCB + nSB (1)

In the same way, nCB was related to ~M by

(2)

where k' was a constant. By replacing nCB in Equation (1) with .

k'nBM'we get:

~CR = kk'(l-y)~BM + ~SB (3)

. -1 The rate of change of frequency f(Hz sec ) of a quartz crystal micro-

balance (at constant temperature) is given by (7,8)

f = k"~

with: k" = 1.079 1016

M Hz molecules cm-2 sec-l

(4)

where M is the molecular mass of the gas and n is the condensation

-2 -1 rate (molecules em sec ) on the microbalance surface. The micro-

balances used in this study were practically identical in construction.

Page 16: Condensation and sublimation of carbon dioxide and water

Therefore, k" was assumed to be the same for all of them. Replacing

the various n in Eq. 3 with the corresponding values of f of Eq. 4,

we get

0 0

kk'(l-y)fBM + fSB (5)

A more convenient form of Eq. 5 is:

= kk'(l-y) (6)

The constant kk' was evaluated by a separate series of measure-

ments. This was done by raising T8 high enough (T8 > 200 K) so that

y and fSB were immeasurably small (with no condensate on CB). With

the molecular beam turned on, this condition gave (from Eq. 6)

This value was found to vary less than 0.1% in the range 5 x 1013 <

16 -2 -1 nCB < 10 molecules em sec This means that the spatial distribu-

tion of molecules from the molecular beam source or from the copper

0

block surface was independent of nCB in this range. kk' was also

6

measured by depositing some amount of co2 or H20 on the bare copper

block at 55°K. A change of frequency ~fBM on the microbalance BM is

directly proportional to the amount of gas deposited on CB. By raising

the temperature of CB, we sublimated all the deposited gas on CB and got

a change

The

of frequency 6fCR on the 6fCR

ratio ~ was found to BM

microbalance CR.

tcR be equal to ~ for

fBM the two different

geometries (Figs. 1 and 2). This means that the spatial distribution

Page 17: Condensation and sublimation of carbon dioxide and water

7

of the molecules leaving the surface is the same in the case of sublima-

tion as in the case of reflection. This spatial distribution follows

the diffuse cosine law (Appendix A).

Experimentally kk' was found equal to 0.101 for Fig. 1 and 0.178

for Fig. 2.

For many experiments it was necessary to know the coverage

(molecules cm-2) as a function of position on the surface of CB. This

coverage was calculated from the change of frequency of the micro-

balance BM (which was proportional to the amount of material that

impinged) and the change of frequency of the microbalance CR (which

was proportional to the amount of material that sublimated or did not

stick) .

The number of molecules n8 sticking per second on the copper block

CB was:

(7)

Replacing y by 1-(1-y), we obtain:

(8)

Making use of Eqs. 1 and 2, Eq. 8 becomes:

Factoring k', we get

(9)

Page 18: Condensation and sublimation of carbon dioxide and water

Making use of Eq. 4, Eq. 9 becomes: . feR kk I )

(10)

Since k, k', k" are constants, Eq. 10 can be easily integrated.

IJ.fCR = k'k" (!J.f ) BM - kk' (11)

8

/J.fBM' /J.fCR and kk' were measured experimentally and k" was known. Thus

k' was the only quantity needed to calculate !J.n8 . k' was calculated from

geometrical considerations, assuming that the spatial distribution of

gas emission from the source obeyed the diffuse cosine law. .

If N is the flux from an emitting disc of radius e, the flux N o a

at point A can be calculated according to the relationship (10) .

. N

F a =- = .

N 0

1 [1

2 -4 2 2

r e

(12)

where e is the radius of the source, L is the distance of a plane paral-

lel with the source and passing through the point, and r is the distance

from the point to a line passing through the center of the source. As

the copper block is parallel to the source,the value ofF changes with

r (Fig. 7). Consequently some population density gradient was present

on the copper block.

It was useful to define an average geometrical factor F for the

copper block:

f A

where dAi is the ith element of surface, ;FCB is th,e geometrical factor i

Page 19: Condensation and sublimation of carbon dioxide and water

of the ith element, R is the radius of the copper block, and A is the

domain of integration.

Calculation of k':

In the case of the microbalance BM, the change in frequency is

proportional to the flux at the center of the microbalance and:

nBM F =- =

BM · N

0

from Eq. 2,

we get:

9

Since the copper block CB and the microbalance BM have the same emitting

. source of flux N

0

nCB No k' =-,-X-.-=

N 0

In system 1 (Fig. 1)

LBM = 2. 76 em

= 2.32 em

e = 0.11 em

Using Eq. 12, we obtain

-4 FBM = 5.45 x 10

For the copper block, the dimensions applying to Eq. 12 were

Page 20: Condensation and sublimation of carbon dioxide and water

LCB = 3. 79 em

1.35 ~ reB S 3.89 em

e = 0.11 em

10

The curve of FCB as a function of r (Fig. 7) can be represented approxi­

mately by a straight line in the range r = 1. 35 to 3. 89 em. Furthermore,

considering the geometry of the copper block, we can consider that

FCB ~ FCB at the center of the copper block. Using Eq. 12, we obtain

-4 FCB = 3.85 x 10

Therefore, for system 1, k' = FCB/FBM = 0.71. From the curve (Fig. 7),

we see that the coverage gradient will be as high as 60%.

In system 2 (Fig. 2), the dimensions applying to Eq. 12 were

LBM = 5.78 em

rBM = 3.19 em

e = 0.11 em

so that

FBM = 2.13 10-4

For the copper block

LCB = 4.60 em

-1.27 < rCB < 1.27 em

e = 0.11 em

Considering the symmetry of the copper block around the axis normal

to the center of the source

Page 21: Condensation and sublimation of carbon dioxide and water

J R

0

11

F CB 27Trdr

Since FCB changes only 14% in the interval 0 < rCB < 1.27, a sufficient

approximation for FCB is:

FeB = F(; 1.27) = 5.34 x 10-4

From the curve of Fig. 7, we see that the coverage gradient will be

less than 8%. Therefore, for system 2

k' 5.34 X 10-4 2.50 = =

2.13 X 10-4 (15)

C. Gases Investigated

Two gases, water vapor and carbon dioxide, were investigated.

The carbon dioxide used was research grade, certified to have a purity

better than 99.99%, the main impurity being nitrogen. However, at

the lowest molecular beam intensities, our mass spectrometer sometimes

indicated a H20 impurity level (originating in the vacuum system) as

high as 0.4 mass per cent. Because 1-y was measured directly and

because y for H20 is nearly unity at those temperatures (as will be

shown) , the effect of the H20 impurity on (1-y) for co2 was considered

to be negligible.

A pyrex bulb containing liquid water was used as the source of

water vapor. This water was twice distilled before being placed in

the freshly cleaned and rinsed bulb. The bulb was then sealed and the

water outgassed by pumping on the heated liquid with a zeolite-trapped

mechanical vacuum pump. In spite of these precautions, the mass

spectrometer showed that H2o gas contained co2 at levels as high as 0.7

per cent. To study the effect of this impurity, we varied the co2

Page 22: Condensation and sublimation of carbon dioxide and water

12

content of the H20 and measured (1-y) as a function of this percentage

to a maximum of five mole per cent, T5 being maintained in the domain

135°K to 142°K, (Fig. 8). This dependence was used to correct (1-y)

in Table V.

Page 23: Condensation and sublimation of carbon dioxide and water

-I-

------- BR --

..... -

..... IC".' -1--

-

\ j~ , '(" ""''E' a;

I

~ ./

/'' / '\' / 1--, "

LIQUID NITROGEN

V BAFFLE V SOURCE

CR //II I \ ' BM/ 1 \ ',

\\ ' ~~CB

I ·- --

Figure 1. System 1

13

1-

---------

1-

-----

Page 24: Condensation and sublimation of carbon dioxide and water

-

LIQUID NITROGEN

14

-

BAFFLE

·soURCE

....__,_,J1 \, __ .... BR -- 11 11 \ --CR

I I I \ I I I \

I I I \ I I

I I BM ,I I

ICm I I

-- --Figure 2. System 2

Page 25: Condensation and sublimation of carbon dioxide and water

GAS BOTTLES

CAPACITANCE MANOMETER

TRAP

2

FORE PUMPS

1

TRAP

FV2

FV1

GBV

1

2

3

4

LHV

PIRANI 4

EV2

EVl

PIRANI 3

APCV

THERMO­COUPLE GAUGE

ION GAUGE 3

Figure 3. Vacuum System

PIRANI 2

rev

PIRANI 1

15

CRYOSTAT

ION GAUGE 2

MBV

VALVES ® GAUGES 'V

cv

Page 26: Condensation and sublimation of carbon dioxide and water

... ~

MASS FILTER J-

t::] F , MBV l ~ -~ -DI FFUSION PUMP

~ ~ cv

~ DI FFUSION PUMP ;--;I ~~~

L- 1-..

;:-6() .,

ME CHAN !CAL PUMP

N ITROGEN ~ r-; -----

..--DCJ - --1"11-

MECH ANICAL PUMP --- ...... ~

- - - ~

- - - ~ -- - - - ... ROD - - - - --- - - ~ "'~ -

- I'"' ~ r- -I - .... ~ ........ -- ·~--.a. - - _, - ,_- -

I '

CHART RECORDER

H.P. KEY BOUND

'"'

H.P. DIGITAL

H.P. SERVIAL

H.P. COMPUTER COUNTER

OSCILLATOR

.,._ ___ NITROGEN rr~

... --= - MOLECULAR BEAM

---1-

r:o

- ~PUMPED NITROGEN I-' -- - TEFLON SPACER

-- NOZZLE -=:. --- MICROBALANCES

-SHUTTER COPPER BLOCK I \

Figure 4. Molecular Beam

16

Page 27: Condensation and sublimation of carbon dioxide and water

17

Figure 5. Bottom Plate of Vacuum Chamber

Page 28: Condensation and sublimation of carbon dioxide and water

,-... r-l I

0 a.l

(J)

;<

N ::I:l ,_,

t)

~ 0'

~ 1'<-1

~

t'5

~ 1'<-1 0

l'<:t

~

BEAM OFF BEAM ON I ~cRL-----------­

cR MICROBALANCE

fSB L ______ _

I I I I I I I I I I I

BM I I MICROBALANCE I I

BEAM OFF

fBM~----------------._------------~------------------~

TIME

Figure 6. Procedure for Measurements

.... ()0

Page 29: Condensation and sublimation of carbon dioxide and water

9

6

3

6

I '/

I I

I I

I I

I I

I I

3

I I

I I

I

,.L' ., r , / ' / I

0 DISTANCE TO THE BEAM AXIS (em)

3

Figure 7. Change in Geometrical Factor with r

19

6

Page 30: Condensation and sublimation of carbon dioxide and water

16

12

-'I ..-I '-" 8

4

0

0 2

MOLAR PERCENTAGE OF C02

A

4

Line expected if all co2 is reflected

Figure 8. Effect of co2 in Water on y

20

6

Page 31: Condensation and sublimation of carbon dioxide and water

21

III. RESULTS AND DISCUSSION

This study showed the condensation coefficient y to be a very

complex quantity related to many variables such as: the substrate

temperature TS' the beam temperature TG' the beam flux ¢, the popula­

tion of deposited molecules, the history of the deposit, and finally

the purity and the nature of the substrate.

To study independently the effect of each variable, we limited

ourselves to the three following simple cases:

1. Low population density (<100 molecular layers)

Here, to control exactly the coverage and also the effect of the

substrate, we were limited to low fluxes and also to a low substrate

temperature in order to avoid a high rate of sublimation.

2. High population density (>1000 molecular layers)

In this case we were able to investigate the influence of low

and high fluxes, and also relatively high substrate temperatures on

condensation coefficients.

3. Intermediate population density (100 to 1000 molecular layers)

From the results in these three fundamental cases, it is possible

to have an idea of what the condensation coefficient may be in more

complex cases.

A. Low Coverages

1. C02 Experiments

System 2 (Fig. 2) was used for these experiments. About 2 x 105

layers of water molecules were deposited on the 100°K copper block

Page 32: Condensation and sublimation of carbon dioxide and water

(CB) so as to provide a known, clean substrate. Before each experi­

ment, CB was heated to 150°K for a couple of minutes. This allowed

22

all C02 and also at least 200 layers of water to be evaporated, leaving

behind a reproducible solid water surface. This surface was protected

from any impurity that could come through the beam orifice by closing

a special shutter located just above the CB (Fig. 4). After this

cleaning process, the temperature of CB was allowed to decrease. In

about four hours the temperature of CB was low enough to conduct the

following experiment.

Two methods were used to turn the molecular beam on. In the first

one, the shutter protecting the copper block was opened, and the beam

turned on a little later. The intensity of the beam became constant

after about 20 sec. Recording of data began only 30 sec after the

molecular beam had been turned on. The second technique consisted of

setting the intensity of the flux with the shutter closed. Then

the shutter was opened, and the results recorded immediately. This

second technique had the disadvantage of sometimes disturbing the

stability of the microbalances (because of a sudden change in the

capacitance of the electronic system).

With TG' T5 , and ~ constant, we recorded the frequency change as

a function of time after turning on the molecular beam (Figs. 9 and 10).

Most of the experiments were done at temperatures so low that the

sublimation rate was negligible. The results are presented in Table I

and Figs. 11-14.

In earlier experiments, no care was taken to protect the water

substrate from the impurities that could come from the vacuum system.

Page 33: Condensation and sublimation of carbon dioxide and water

23

Before each experiment, T8 was raised to 85°K. This allowed all co2

to be evaporated, without evaporating any water. The same experiments

that were previously described with the clean water substrate were

carried out with this contaminated water substrate. The results are re-

ported in Table II and Figs. 15 and 16.

2. H20 Experiments

Two experiments were made at low coverages with H20. The first

employed system 1. The copper block was cleaned by raising its tempera­

ture to 200°K and allowing it to cool to 141°K. Then the condensation

coefficient was measured as a function of time with the molecular beam

on. The results are shown in Fig. 17. In the second experiment,

carried out with system 2, about 10 layers of water were deposited on the

bare copper block (100°K). Then, the temperature of the copper block

was raised to 147.5°K and y was measured as a function of the population

density. The results are shown in Fig. 18. By making use of Fig. 17,

y can be plotted as a function of the coverage for the first experiment.

These results are given in Fig. 18.

The effect of the history of the coverage can be seen in Fig. 18.

Although TS is 6.5°K higher for the second experiment, we find a higher

sticking coefficient y for the same coverage. This is contrary to

what would have been expected. However, since heating CB at 200°K is

not sufficient to produce a clean and well-defined substrate, these

experiments are mostly qualitative. The following discussion concerns

co2 • H20 behaved in a similar manner.

3. Discussion

When the flux was constant, it was noticed that y tended rapidly

to zero if T8 was higher than some critical temperature TC. The

Page 34: Condensation and sublimation of carbon dioxide and water

24

existence of critical temperatures was reported as early as 1916 by

Knudsen (11) and Wood (12) for metal vapors. Later Frenkel (13) develop-

ed a theory for condensation based on the heterogeneous nucleation of

the vapor on the substrate. From statistical considerations he was

able to relate the critical temperature to the flux by the relation:

~ = (4cr ~ )-l exp(-H/kT ) 0 0 c

where cr is the cross section of the atom, ~ is the average time of 0 0

adsorption, and H is the sum of the energy of adsorption of a single

atom to the substrate and the dissociation energy of a pair of atoms.

This same formula was used successfully for different molecules by

Heald and Brown (1). For co2 deposited on a copper block, they reported

~ = 3.3 x 1027 exp(-2300/T ) c

For the flux used in our study, this formula predicts TC = 72.9°K. When

the substrate was clean water, we found: 74.46 < TC < 76.40, and for

contaminated water 78.0 < TC < 78.9. These differences in TC can be

explained by the differences in the substrate (14) and the geometry of

the system (15). Since the nucleation theory successfully predicts

y = 0 £or T5 > TC' it was of interest to determine whether or not the

same theory would predict the experimental value of y for T5 < TC.

a. Nucleation Theory

The classical theory of nucleation was elaborated as early as

1924 (13,14). It is based on the fact that when a cluster C. composed ~

of i molecules is formed, the Gibbs free energy of the system is in-

creasea by an amot.mt

Page 35: Condensation and sublimation of carbon dioxide and water

25

~G. = (~ - ~ )i + Ai2/ 3 ~ s 0

where ~s is the potential energy of the molecules in the solid

~0 is the potential energy of the molecules outside the solid, and

A is a constant that depends upon the shape of the cluster and the

structure of the interface between the cluster and the substrate.

As i increases, G. will first increase up to a maximum, G~ correspond-~ ~

ing to i*, the critical size. For i > i*, clusters having less than

i* molecules will be unstable and will have a tendency to break up into

free molecules.

This classical theory (17) has been improved (18-32) recently,

particularly in the treatment of clusters of a few molecules. For such

small clusters, macroscopic variables, such as surface tension and

surface free energy, have little meaning. The improvements are mostly

based on statistical mechanical considerations.

b. Interpretation of the Experimental Results

For T8 < TC' the results support the idea (51) that condensation

takes place in two different steps: First, adsorption and then growth

through nucleation.

1. Adsorption

The adsorption step is thought to correspond to the part of the

curve where the reflection coefficient increases with the time that the

beam is on (Figs. 14 and 16). However, the two steps, adsorption and

nucleation, are probably going on simultaneously. Therefore, only a

rough estimate of the amount of co2 that is adsorbed before nucleation

occurs can be made from the measurements of 1-y. This can be done by

Page 36: Condensation and sublimation of carbon dioxide and water

26

integrating the product ~ydt in the interval •t=O to t corresponding to

1-y maximum, this concentration is called m • This integration, made 0

graphically, gave form the results.presented in Table III. The 0

amount m0 of adsorbed co2 appears to be two to three times larger.in

the case ·of contaminated water than in the case of clean water. This

could be due to the fact that since the contaminated water substrate

was never heated above 100°K, it had a more porous structure (29).

2. Growth Through Nucleation

A simple model identical to the one of Walton (51) is presented.

The substrate is assumed to have a part of its relative area S covered

with clusters of co2 , on which the condensation coefficient is a. The

remaining area(l-S) is partially covered with co2 monomers, and in

this area the sticking coefficient of impinging molecules is a. Consequently, the measured sticking coefficient y is:

y = as + (1-S)S (16)

The following factors may contribute to the change in the relative

area S covered with clusters:

(1) Condensation and diffusion of the co2 molecules impinging

on the clusters.

{2) Diffusion of the C02 molecules to clusters from the area (1-S).

{3) Nucleation at actives sites on the area (1-S).

{4) Formation of new clusters by collision of free co2 molecules

on the area {1-S).

(5) Decrease of the size of the clusters by evaporation.

(6) Decrease of the size of the clusters by diffusion of the co2

molecules from the clusters.

Page 37: Condensation and sublimation of carbon dioxide and water

Among those factors, the following are negligible:

(a) The diffusion of the co2 molecules from the clusters, since

this reaction is energetically unfavorable (29) .

27

(b) The evaporation of the clusters, because the rate of sublima-

tion at the temperatures of interest for clean water substrate

was found to be very small (less than 5% of the reflected

molecules).

The remaining factors, the diffusion of co2 molecules to a cluster,

the nucleation at actives sites, and the formation of new clusters by

collision, depend on the area (1-S). The condensation and diffusion

of molecules impinging directly on the clusters depend on the area S.

If ka is the probability of co2 molecules to impinge on an active site,

kc is the probability for the free co2 molecules to collide and start

a cluster, kd is the probability for the C02 molecules to diffuse to a

cluster, and k is the probability of a molecule impinging on the cluster s

to diffuse at the base of the cluster, then the increase in the relative

area is given by the equation:

dS = K[(k +k +kd)(l-S) + k S]dt a c s

(17)

where K is a constant of proportionality related to parameters such as

the flux intensity and the cross section of the co2 molecules. Setting:

and

Eq. 17 becomes:

Page 38: Condensation and sublimation of carbon dioxide and water

that integrates to:

or:

the boundary condition S=O at t=O gives:

kl C = ln k -k

2 1

After the necessary transformations, we get:

Substituting S into Eq. 16 gives:

or:

(18)

The plot ln(l-y) versus time t was experimentally found to be linear

28

in the cases where the rate of sublimation can be neglected (Figs. 11-13).

This suggests that in Eq. 18:

(19)

Page 39: Condensation and sublimation of carbon dioxide and water

29

Since the condensation coefficient of co2 on co2 at high coverages was

found close to unity, a first order approximation is a=l.O. Then, Eq. 18

becomes:

(20)

Equation (20) is based on the linearity of the figures 11-13 and should

be viewed with caution. However, it is of considerable interest to

examine two cases which would satisfy the required relationship, namely

when S~l and when k2~o. Experimental measurements indicate that S~l

and in fact may be very small, leaving the suggestion that k2 may be

small.

If k2 is negligible compared to k1 and if the diffusion process is

considered (23,24,26) to be the dominant factor in the formation of

clusters, the rate of growth of clusters should be proportional to:

where ED is the activation energy for diffusion. Under these conditions

k1 can be estimated from the slopes of the straight lines in Fig. 11 and

12, and if surface diffusion is the main mechanism for growth, ln(k1)

plotted against ; should show a linear relationship with slope of -E0 /kB. s

The relative change of ln(k1) versus l/T5 was plotted (Fig. 19). The

fact that the points are not on a straight line may indicate that either

the diffusion is not the sole mechanism for cluster growth or that

ED is a function of T5 •

Page 40: Condensation and sublimation of carbon dioxide and water

B. High Coverages

1. C02 Experiments

These experiments were carried out using system 1 (Fig. 1). The

population density was of the order of 1019 molecules cm-2 (~3 x 104

molecular layers), and was kept constant within 30%.

The results are reported for different TG, T8 , and fluxes in

Table III. The dependence of (1-y) on impingement rates and surface

temperature T8 is shown in Figs. 22 and 23 for gas temperatures

TG = 152°K and TG = 2.74°K. The dependence of (1-y) on the reciprocal

of T8 for TG = 152°K is shown in Fig. 24. Impingement rates near the

extremes indicated by the vertical dashed lines in Fig. 22 produce

different curves of log (1-y) versus l/T8 in Fig. 24.

A very interesting way of p~esenting these same results is shown

30

in Fig. 25. The only variables to take into account are the temperature

of the gas and the ratio of fluxes R = ~~~ where ~ is defined as the e e

equilibrium flux, i.e. the flux equivalent to the flux of molecules

leaving by sublimation. From kinetic theory:

~ = p I l2ttmkTS e S

where PS is the vapor pressure derived from the sublimation rate.

m is the molecular mass of the vapor, T8 is the temperature of the

substrate, ~ is the Boltzmann constant.

Although the same curve may be valid for higher values of T8 , we

could not employ this technique.

2. H2o Experiments

A few experiments at high coverage were carried out for water.

However, these experiments appeared to be more difficult and more

Page 41: Condensation and sublimation of carbon dioxide and water

31

inaccurate than for C02 . The difficulty arose because the crystal micro­

balances were not able to function correctly with a high coverage of

water (>5000 molecular layers). Due to the damping effect of the

porous water ice film, the microbalances had a tendency to quit vibra-

ting. The inaccuracy was caused by the C02 impurity which was always

present. The percentage of this impurity was measured with the mass

spectrometer. However, the measurements were made only at very small

fluxes because the monopole could only be used at pressures below

-5 10 Torr. Extrapolating this percentage of co2 for higher pressures

added a supplementary uncertainty. Table IV presents the results ob­

tained with System 1 for coverages higher than 6 x 1017 molecules cm-2

This table also gives the mole per unit impurity level of co2 , and the

corrected (1-y) for H20 according to Fig. 8.

3. Discussion

According to the one dimensional trapping theory of McCarroll and

Ehrlich (34), which we have applied to C02 and H20 condensing on their

own solids, y=l in the ranges of TS and TG used in this study. However,

these trapping theories have nothing to say about the influence of the

particles impingement rate on y. With the exception of Armand's treat-

ment (35), the effect of surface temperature on y is not accounted for

in these theories. Figs. 21-24 show that both these parameters do

influence y. Similar observations have been made by other investiga-

tors (7,37). A decrease of y with an increase of TS is generally ob­

served for a constant flux (1,7,37). An increase of y as the flux is

increased is also generally observed at a constant TS (1). The experi­

mental results shown in Figs. 20-22, agree with these two facts, with

Page 42: Condensation and sublimation of carbon dioxide and water

32

one exception (Fig. 20).

Two main factors that may contribute to the value of the reflection

coefficient are: (1) an increase in the sublimation rate of the molecules

already accommodated on the substrate, and (2) a partial reflection of

the impinging molecules that did not completely accommodate.

a. Increase in the Sublimation Rate

As the molecular beam is turned on, this creates an increase in

pressure above the substrate. From classical thermodynamics an increase

in the sublimation rate is expected. In the particular case under

study this effect is very difficult to evaluate since we have a non­

equilibrium situation. However, a comparison can be made with a hypo­

thetical system where the substrate is in equilibrium with the vapor,

and an inert gas of same molecular weight is introduced to raise the

total pressure. This calculation was made. The results showed that

the increase in pressure above the substrate had a negligible effect

on the measured reflection coefficient.

However, the thermal energy carried by the impinging molecules

might have an effect on (1-y). Consider that the molecules which are

in the process of sublimating are already excited. As the molecular

beam is turned on, the impinging molecules transfer enough thermal

energy to allow some of the excited molecules at the surface to leave

at a faster rate that they would have if undisturbed. The effect would

be equivalent to an increase in the measured reflection coefficient.

b. Partial Reflection of Molecules not Accommodated

This is the only factor generally considered (7,34,35). The fact

that {1-y) was found to vary mainly with the ratio of fluxes R (called

i'','

Page 43: Condensation and sublimation of carbon dioxide and water

33

also supersaturation in nucleation theories) could be an indication

that (1-y) is related to the homogeneous nucleation process. The low

coverage results indicated that, a significant population density of

monomer molecules results in relatively large values of (1-y). One

model that can explain this is the collision between a gas molecule and

a single molecule or a very small cluster on the surface. In this case

poor energy transfer between the gas molecule and the substrate would

be expected because of poor mechanical coupling. Thus the effective

accommodation coefficient would be lowered with an increase in the popu-

lation of observed monomers or small clusters on the surface. For the

case of high coverages, the average population density of monomers should

decrease with increasing beam flux. This would be due to the higher

rate of cluster formation at the surface. Furthermore, as the beam

temperature increases, it will take longer for a molecule from the

gas phase to lose its kinetic energy on the surface. The rate of

formation of clusters will be reduced and the average time for a

molecule to be accommodated to the surface temperature will be

increased. An increase in the reflection coefficient should result.

As the surface temperature T5 increases, more monomers on the surface

will be generated by excitation of surface molecules as the sublimation

increases. An increase in the reflection coefficient (1-y) should be

expected. The experimental data are in agreement with this simple

model.

C. Intermediate Coverages

1. C02 Experiments

These results were obtained by M. Chourain in his master's thesis

(37). 16 -2

The procedure was to deposit about 2 x 10 molecules em of

Page 44: Condensation and sublimation of carbon dioxide and water

co2 on the copper block CB at 55°K. Then by heating CB, and turning

the molecular beam on at different T5 , y was measured for a flux of

12 -2 -1 9 x 10 molecules em sec Since neither the flux intensity ¢

34

nor the rate of sublimation ¢ were ever high, we can consider that the . e

coverage remained practically constant.

By plotting Chouarain's data for (1-Y) as a function of the ratio

R, we obtain Fig. 24.

2. H20 Experiments

Some measurements were made of (1-y) for water at coverages of

16 -2 about 5 x 10 molecules em • The flux used was 2.3 x 1013 molecules

-2 ~1 em sec except for a few experiments. These results for H2o are

presented in Fig. 25. The results for high coverages, presented in

Table IV, are also included. No correction was made for C02 impurity.

However, we have to be careful with these results, particularly

when T5 is relatively high (T5 > 150°K). At those temperatures (1-y)

may be higher than expected. To show this, an experiment was carried out

with a small coverage of H20 (2 x 1016 molecules cm-2) maintained con­

stant with less than 30% variation by an appropriate use of the flux.

13 -2 -1 The intensity of the flux was 5 x 10 molecules em sec and the

temperature of the copper block was first raised and later lowered.

These results are presented in Fig. 26. It is apparent that in this

case (1-y) was dependent on the thermal history of the ice film, which

means that in general this type of data are not expected to be reproduc-

ible. However, the effect is reproducible. This was shown to be the

case by a second set of measurements which gave results similar to

those shown in Fig. 26.

Page 45: Condensation and sublimation of carbon dioxide and water

35

3. Discussion

The results at intermediate coverages agree approximately with

the results at high coverages; (1-y) is generally found about 50% higher

in those cases. However, when T8 is relatively high, (1-y) increases

disproprotionally. This may be due to the rearrangement of molecules

at high values of T8 • Such a rearrangement would probably leave parts

of the substrate poorly covered. A variation of the reflection coef­

ficient would result, similar to that shown in Fig. 26.

For water the experimental curve (Fig. 25) has the same shape

as for co2 (Fig. 24). These results for water are a maximum since

no correction was made for the C02 present. Furthermore, most of the

results are at intermediate coverage.

Page 46: Condensation and sublimation of carbon dioxide and water

36

Table I. Sticking Coefficient of co2 on a Clean Water Substrate

Surface -13 Beam Flux x 10 Time Beam on Expected Error Temper-ature (molecules) 1-y

CK) 2 (sec) tl(l-y)

em x sec

76.40 6.65 30 0.98 0.05

76.40 6.65 150 o. 97 0.05

76.40 6.65 390 0.96 0.05

76.40 6.65 870 0.96 0.05

74.46 6.65 30 0.92 0.05

74.46 6.65 60 0.88 0.05

74.46 6.65 120 0.84 0.04

74.46 6.65 180 0.80 0.04

74.46 6.65 240 o. 77 0.04

74.46 6.65 360 0.69 0.04

74.46 6.65 480 0.64 0.04

74.46 6.65 600 0.58 0.03

74.46 6.65 720 0.55 0.03

74.46 6.65 840 0.49 0.03

74.46 6.65 960 0.44 0.03

74.46 6.65 1080 0.40 0.03

74.46 6.65 1200 0.37 0.02

74.46 6.65 1320 0.34 0.02

74.46 6.65 1440 0.31 0.02

74.46 6.65 1560 0.28 0.02

74.46 6.65 1680 0.26 0.02

74.46 6.65 1800 0.23 0.02

*74.46 6.65 2100 0.23 0.02

74.46 6.65 2340 0.19 0.02

**77.25 6.65 2400 0.23 0.02

77.25 6.65 2640 0.215 0.02

77.25 6.65 2880 0.20 0.02

77.25 6.65 3120 0.185 0.02

77.25 6.65 3360 0.172 0.02

Page 47: Condensation and sublimation of carbon dioxide and water

'37

Table I. (continued)

Surface -13 Beam Flux x 10 Time Beam on Expected Error Temper-ature (molecules) 1-y (oK) 2 (sec) ll(l-y) em x sec

73.04 6.65 30 0.87 0.05

73.04 6.65 90 0.64 0.04

73.04 6.65 150 0.50 0.03

73.04 6.65 210 0.42 0.03

73.04 6.65 270 0.35 0.02

73.04 6.65 330 0.28 0.02

73.04 6.65 450 0.18 0.01

73.04 6.65 510 0.15 0.01

72.91 6.65 5 o.oo 0.01

72.91 6.65 10 0.15 0.01

72.91 6.65 15 0.37 0.01

72.91 6.65 20 0.57 0.02

72.91 6.65 25 o. 73 0.03

72.91 6.65 30 0.80 0.04

72.91 6.65 60 0.59 0.03

72.91 6.65 90 0.48 0.03

72.91 6.65 120 0.40 0.02

72.91 6.65 150 0.34 0.02

72.91 6.65 180 0.29 0.02

72.91 6.65 210 0.26 0.02

72.91 6.65 240 0.22 0.02

72.91 6.65 300 0.16 0.01

72.91 6.65 330 0.14 0.01

72.91 6.65 360 0.11 0.01

72.91 6.65 390 0.10 0.01

70.91 2.17 10 0.03 0.01

70.91 2.17 25 0.27 0.02

70.91 2.17 45 0.54 0.03

Page 48: Condensation and sublimation of carbon dioxide and water

Table I. (continued)

Surface Tempera­ture

Beam Flux x lo-13

(molecules) Time Beam on Expected Error

(oK)

70.91

70.91

70.91

70.91

70.91

70.91

70.91

70.91

69.30

69.30

69.30

69.30

69.30

65.50

65.50

2 em x sec

2.17

2.17

2.17

2.17

2.17

2.17

2.17

2.17

2.17

2.17

2.17

2.17

2.17

2.17

2.17

(sec)

65

85

140

200

260

320

440

560

5

30

55

70

95

30

150

* Molecular beam was turned out during 300's

1-y

0.70

0.81

0.65

0.54

0.48

0.41

0.34

0.28

0.00

0.07

0.24

0.14

0.05

0.01

0.01

** Temperature T was increased from 74.46°K to 77.25°K s

~(1-y)

0.03

0.04

0.03

0.03

0.03

0.02

0.02

0.02

0.01

0.01

0.02

0.01

0.01

0.01

0.01

38

Page 49: Condensation and sublimation of carbon dioxide and water

39

Table II. Sticking Coefficient of COt on Contaminated Water Substra e

Surface -13

Beam Flux x 10 Time Beam on Expected Error Temper-ature (molecules) 1-y

(oK) 2 (sec) ~(1-y) em x sec

78.9 6.65 30 0.61 0.03

78.9 6.65 60 0.85 0.04

78.9 6.65 120 0.92 0.04

78.9 6.65 180 0.99 0.04

78.9 6.65 240 0.99 0.04

78.9 6.65 960 0.98 0.04

78.0 6.65 30 0.51 0.02

78.0 6.65 60 0. 71 0.03

78.0 6.65 120 0.81 0.03

78.0 6.65 180 0.82 0.03

78.0 6.65 240 0. 77 0.03

78.0 6.65 300 0.73 0.03

78.0 6.65 540 0.60 0.03

78.0 6.65 780 0.53 0.03

78.0 6.65 1020 0.48 0.03

77.30 6.65 60 0.51 0.02

77.30 6.65 90 0.59 0.03

77.30 6.65 120 0.57 0.03

77.30 6.65 180 0.43 0.03

77.30 6.65 240 0.39 0.03

77.30 6.65 300 0.37 0.03

77.30 6.65 420 0.35 0.03

77.30 6.65 600 0.28 0.03

77.30 6.65 840 0.26 0.03

77.30 6.65 1080 0.24 0.03

Page 50: Condensation and sublimation of carbon dioxide and water

Table III. Estimated Amount of co2 Adsorbed on H20 Substrate (at Maximum ~1-y))

Substrate

Clean water

Contaminated water

Surface Temperature

(oK)

72.91 70.91

78.9 78.0 77.3

Beam flux x lo-13

(molecules) 2

em x sec

6.65 2.17

6.65 6.65 6.65

m x l0-15 0

(molecules) 2 em

1.2 ± 0.2 1.0 ± 0.2

2.6 ± 0.3 3.6 ± 0.5 3.9 ± 0.5

40

Page 51: Condensation and sublimation of carbon dioxide and water

41

Table IV. Condensation Coefficient of C02 at High Coverages

TG Ts cp X 10-14

(molecules) 4

R (1-y) X 10 (oK) (oK) 2 em x sec

133 55.3 5xl09 121 2 ± 1

133 74.6 412 39 11 ± 1

133 78.0 9.5 6.3 35 ± 3

133 78.0 6.1 4 39 ± 3

133 88.4 0.32 31 220 ± 50

133 89.7 Ool2 20 270 :j: 50

152 70.7 12850 104 4.8 ± 0.5

152 70.7 5029 40.7 4o0 ± 0.5

152 70.7 2026 16.4 3.8 ± 0.5

152 70.7 741 6 3.0 ± 0.5

152 75.5 757 122 18 ± 1

152 75.5 112 18 21 ± 1

152 75.5 47.2 7o6 26 ± 1

152 78.8 114 116 24 ± 1

152 78.8 17.7 18.1 30 ± 1

152 80.4 56.5 130 30 ± 2

152 80.4 27.4 63 32 ± 2

152 80.4 7.7 17.6 40 ± 5

152 80.4 3.5 8 52 ± 8

152 82 0 7 18.4 147 37 ± 5

152 82.7 6.3 50 52 ± 5

152 82.7 2.3 18 90 ± 20

152 82 0 7 0.8 6 100 ± 30

152 85.1 6.1 140 42 ± 5

152 85.1 2.2 50 72± 10

152 85.1 0. 72 16.5 140 ± 20

152 85.1 0.26 6 220 ± 50

152 86.8 2.0 100 75 ± 10

Page 52: Condensation and sublimation of carbon dioxide and water

42

Table IV. (continued)

TG Ts cj) X 10-14

R (molecules) 4 (oK) (oK) 2 (1-y) X 10

em x sec

152 86.8 1.0 50 120 ± 20

152 91.6 0.30 110 150 ± 30

152 91.6 0.123 45 200 ± 50

256 59.5 8.2xl0 7 120 8 ± 2

256 59.5 4.2xl0 7 62 8 ± 2

256 59.5 2.0xl0 7 30 8 ± 2

256 70.0 2967 15 11 ± 2

256 70.0 1187 6 15 ± 2

256 74.0 303 20 15 ± 2

256 74.0 197 13 14 ± 2

256 80.0 6.7 12 55 ± 5

256 80.0 4.7 9 67 ± 5

256 80.0 3.6 7 86 ± 5

256 83.5 1.7 18.7 210 ± 30

256 83.5 0.92 10 250 ± 30

274 79.1 56 67 67 ± 5

274 79.1 20 24 76 ± 10

274 79.1 12.5 15 100 ± 20

274 79.1 4.3 5.2 115 ± 5

274 79.1 4.6 5.5 120 ± 5

274 79.1 2. 75 3.3 135 ± 5

Page 53: Condensation and sublimation of carbon dioxide and water

43

Table rv. (continued)

TG Ts cp X 10-14

R (molecules) 4 (1-y) X 10

(oK) (oK) 2 em x sec

274 79.1 1.25 1.5 200 ± 20

274 83.0 8.6 74 100 ± 20

274 83.0 1.5 13 325 ± 30

274 83.0 0.53 4.6 370 ± 50

274 88.1 0.83 72.5 260 ± 30

274 88.1 0.19 16.5 500 ± 40

274 88.1 0.08 6.7 540 ± 50

Page 54: Condensation and sublimation of carbon dioxide and water

44

Table v. Condensation Coefficient of H20 at High Coverages

<fJ X 10-14 (1-y) X 10 3

T (1-y) X 103 Mole % co2 Corrected for C02 s

(molecules) (OK) Concentration 2 em x sec

129 1.5 10.0 0.38 1 ± 2

141.5 2.0 8.0 0.38 -1 ± 2

142.0 .25 23.0 0.36 14 ± 3

142.0 4.0 9.6 0.36 1 ± 2

145.5 0.25 29 0.38 20 ± 4

145.5 3.2 10.3 0.38 1 ± 2

150 1.5 19.8 0.67 4 ± 2

150 4.5 14.5 0.67 -2 ± 2

Page 55: Condensation and sublimation of carbon dioxide and water

....... r-l I

C) (I) Cl)

~

N ::c: .._,

p:: u

• 4-l

~

LJ')

0.06

0.03

Rate of change in frequency measured every 5 seconds.

'

¢ = 6 •65 x 1013 molecules 2 em x sec

45

0.0 .. ~----~--------~------~~------~--------~--.. 0 120 240

TIME BEAM ON (Sec)

Figure 9. Change in Frequency Recorded (1)

Page 56: Condensation and sublimation of carbon dioxide and water

........ .-I I

C) Q) {I)

><:

N :::c ~

j:Q u

• 4-1

><:

1.1"\

46

o~r----------------------------------------.

0.03

0

Rate of change in frequency recorded every 5 seconds

cp = 2.27 X 1013

120

TIME BEAM ON (Sec)

molecules 2 em x sec

240

-

Figure 10. Change in Frequency Recorded (2)

Page 57: Condensation and sublimation of carbon dioxide and water

0.8

0.6

"'"' >-I 0.4

...-l -

0.2

¢ = 6.65 X 1013

120 360

molecules 2 em x sec

TIME BEAM ON (Sec)

Figure 11. Reflection Coefficient of co2 Versus Time (1) (Clean Water Substrate)

47

Page 58: Condensation and sublimation of carbon dioxide and water

48

Lor----------------------------------------.

0.8

0.6

->-1

8 0.4

0.2

0

<f> = 6.65 X 1013

BEAM ON

1000

molecules 2 em x sec

I BEAM OFF

I I I

I I I I

2000

77.25

I I I BEAM ON

I I I

TIME (Sec)

Figure 12. Reflection Coefficient of co2 Versus Time (2) (Clean Water Substrate)

Page 59: Condensation and sublimation of carbon dioxide and water

1.0

0.5

0.1

0.05

0

cp = 2.17 X 1013

160

molecules 2 em x sec

TIME BEAM ON (Sec)

320

Figure 13. Reflection Coefficient of co2 Versus Time (3) (Clean Water Substrate)

49

Page 60: Condensation and sublimation of carbon dioxide and water

0.8

0.6

0.4

0.2

0.0

0

cj} = 6.65 X 1013

T = s

molecules 2 em x sec

¢ = 2.17 X 1013

20 40

molecules 2 em x sec

60

TIME BEAM ON (Sec)

80

Figure 14. Reflection Coefficient of C02 Versus Time (4) (Clean Water Substrate)

50

Page 61: Condensation and sublimation of carbon dioxide and water

0.7

0.5

0.3

0

--, / '

\ \ \

\

' '

'

' '

' ' ' '

curve corrected by substracting the effect dueto the sublimation

cf> = 6.65 X 1013 molecules 2 em x sec

'

' ' ' '

300

'

'

' ' '

' ' '

' ' ' '

' \ \ \

' ' '

T s

' ' ,,

600

TIME BEAM ON (Sec)

............ ' ....

' ......... .........

900

51

.....

Figure 15. Reflection Coefficient of co2 Versus Time (1) (Contaminated Water Substrate)

Page 62: Condensation and sublimation of carbon dioxide and water

52

0.4

0 T = 78.0°K (T < T ) s s c

0.2 A T = 77. 3°K (T < T ) s s c

[!] T = 78.9°K (T > T ) s s c

0.0~--~--~----~--~--~----~--~--~--~~__. 0 60 120 180 240

TIME BEAM ON (Sec)

Figure 16. Reflection Coefficient of co2 Versus Time (2) (Contaminated Water Substrate)

Page 63: Condensation and sublimation of carbon dioxide and water

0.4 T = 141°K

s

¢ = 2.8 X 1013 molecules 2 em x sec

TIME BEAM ON (Sec)

Figure 17. Reflection Coefficient of H20 Versus Time (Bare CB)

53

Page 64: Condensation and sublimation of carbon dioxide and water

0.1

1!1

0

10 layers of H20 were first

deposited on CB at 100°K

Bare CB

H20 COVERAGE (molecules x cm-2)

Figure 18. Reflection Coefficient of Water Versus Coverage

54

Page 65: Condensation and sublimation of carbon dioxide and water

10

1

12.8

Figure 19.

55

13.0 13.2 13.4 13.6 13.6

Dependence of the Surface Diffusion Coefficient on T s

Page 66: Condensation and sublimation of carbon dioxide and water

10

1.0

T = 75 5°K-----.._ ___ .. <n s • .

1015

IMPINGEMENT RATE(molecules) 2 em x sec

56

Figure 20. Reflection Coefficient of co2 Versus Impingement Rate (TG = 152°K)

Page 67: Condensation and sublimation of carbon dioxide and water

l.O 14 10 1015

IMPINGEMENT RATE(molecules) 2 em x sec

57

Figure 21. Reflection Coefficient of C02 Versus Impingement Rate (T = 274°K)

G

Page 68: Condensation and sublimation of carbon dioxide and water

1.

0 ~ = 100 - 140 X 1014 molecules 2

~ = 6 - 18 X 1014

em x sec

molecules 2 em x sec

Figure 22. Reflection Coefficient of co2 Versus the Inverse of T5

58

Page 69: Condensation and sublimation of carbon dioxide and water

C""' 0 ...-!

~

........ ?-I

...-! -

100

~ I I

A TG = 256 - 274°K

A 0 TG = 133 - 152°K

I -~ ' T = 70 to 89°K s

101- <:>-.......... - ~ A A

1.0' I I I I I I I I I I I I ' I I I I I I I I ' I I I I I r

0.1 1.0 10

RATIO OF FLUXES R = ~~~ e

100

Figure 23. Reflection Coefficient of co2 Versus the Ratio of Fluxes R

l.n \0

Page 70: Condensation and sublimation of carbon dioxide and water

0

0

--

0

-....

M. Chouarain (37) Data

0 0 000 0

........ .... _ 0 ----ood!t 0~ 0

...... , ......

0 0

0

/--......... 0

High Coverages Results ', from Figure 25. at TG = 133- ', 152°K ',

0.1 1.0

RATIO OF FLUXES R = ¢/¢ e

0 0

.... , ' ..... .........

;;-

Figure 24. Reflection Coefficient of co2 Versus Ratio of Fluxes for Intermediate Coverages

60

Page 71: Condensation and sublimation of carbon dioxide and water

'6 100 .-1

:< ->-' .-1 ~

10

0.01

T = 138 to 152°K T = 275°K G s

e

A high coverages

e intermediate coverages

•e

0.1 1.0

RATIO OF FLUXES R = ~~~ e

Fig~re 25. Reflection Coefficient of H20 Versus the Ratio of Fluxes R

0\ .....

Page 72: Condensation and sublimation of carbon dioxide and water

.3

.2

.1

0

130

16 -2 Coverage: 2 x 10 molecules x em

~ = 5 x 1013 molecules 2 em x sec

Arrows indicate order in which data was taken

Figure 26. Reflection Coefficient of H20 Versus T5 at Constant Flux and Coverage

62

150

Page 73: Condensation and sublimation of carbon dioxide and water

63

IV. VAPOR PRESSURE OF SOLID co2 AND H20

A. Introduction

For studies in ultra-high vacuum and low temperature systems,

the knowledge of the sublimation pressures of compounds like co2 and

H20 is of considerable importance. At the present time, the literature

contains measurements of the vapor pressure of C02 (38,39) and H20 (40)

for pressures higher than 10-3 and 10-S Torr, respectively. Using

these available data, Honig and Hook (41) were able to predict approxima-

tively- the vapor pressures of these compounds for lower pressures.

These predictions need to be tested experimentally. This work

provides accurate data extending from 2 x 10-4 down to 10-9 Torr for

C02 and H20. These data will be analysed and the heat of sublimation

calculated.

B. Experimental Procedure

With the copper block CB held at the temperature of the walls

(55°K), a large amount of gas was introduced through the molecular

beam. No change in the frequency of the microbalances CR and BR was

observed. This meant that all the gas was condensed in the lower por-

tion of the vacuum chamber. T8 was then raised and maintained at

different values. For these different T8 , a rate of change in fre-o

quency was obtained in BR and CR. The rate of change in frequency fCR

of the microbalance CR was recorded as a function of T8 . Since the

spatial distribution of the molecules leaving CB obeyed the cosine

law (Appendix A) . The number of molecules impinging on the microbalance

CR was a constant fraction F of the molecules leaving CB. This

fraction F is given by the Lozgachev formula (10), Eq. 12.

Page 74: Condensation and sublimation of carbon dioxide and water

64

For the microbalance CR:

L = 2.38 ± .01 em

e = 1.27 ± .01 em

r = 0.85 ± .02 em

From these values, we obtain:

F = 0.194 ± 0.006

-2 -1 From the measured number n8 (molecules em sec ) leaving CB, the

equivalent vapor pressure was deduced from the kinetic. theory of gases (7).

where ~ is the Boltzmann constant, and m is the molecular mass of

the gas.

The vapor pressure at equilibrium P is obtained by multiplying e

PS by the condensation coefficient (7). Since y was measured previous­

ly for high coverages and found close to unity,

p ~ p e S

C. Results and Discussion

The results are presented in Table VI for co2 and in Table VII for

H2o. The vapor pressure is plotted as a function of l/T8 on semi-logar­

ithmic paper, in Fig. 27 for co2 and Fig. 28 for H20.

The data were fitted to the equation

ln P = A/T + B (21)

Page 75: Condensation and sublimation of carbon dioxide and water

65

by the least square method.

At these low pressures, we can assume that the vapor behaves ideally;

accordingly we can apply the Clausius Clapeyr~n equation:

ln P fiH

s =- --

RT + Cte

by identification of Eq. 21 and Eq. 22, we deduce that:

fiR = -RA s

(22)

The values of A, B and H are presented in Table VIII, and compared s

with those deduced from the Honig and Hook's (41) extrapolations.

Our data should be very precise, theoretically the highest uncer-

tainty being in the geometrical factor (3%). This error is a systematic

error and is without effect on the value of the heat of sublimation.

However, the experimental points appear to be slightly scattered,

particularly at lower pressures. These errors can be evaluated

graphically on the semi-logarithmic plot of pressure as a function

of l/T8 . From these estimates a maximum error is given for A, Band

fiR in Table VIII. s

For water it appears that below 150°K we have a change in the

value of fiR . This change could be accounted by the fact that at s

those temperatures a more porous structure of ice, called ice IX (29)

appears. From our data we expect this change to occur at 150° ± 10°K,

-1 and the change in entropy of this transition is S = 5 ± 3 Cal. degree

Page 76: Condensation and sublimation of carbon dioxide and water

66

Table VI. Vapor Pressure of CO 2

Temperature Pressure 1000/T.

(oK) (Torr) {oK-1)

102.50 3.16 X 10 -4 9. 756

100.21 1.55 X 10-4 9.979

98.22 7. 92 X 10-5 10.181

96.15 3.74 X 10 -5 10.400

94.19 1.84 X 10 -5 10.620

91.73 7.49 X 10 -6 10.902

90.00 3.23 X 10 -6 11.111

89.85 3.21 X 10 -6 11.130

89.42 2.87 X 10 -6 11.183

88.97 1.99 X 10-6 11.240

88.73 2.02 X 10 -6 11.270

88.65 1.91 X 10 -6 11.280

86.91 1.02 X 10 -6 11.506

86.66 7.89 X 10 -7 11.539

85.03 4.13 X 10-7 11.760

85.00 4.08 X 10 -7 11.765

84.60 2.76 X 10 -7 11.820

84.03 2.46 X 10 -7 11.900

83.96 2.27 X 10 -7 11.910

82.95 1. 72 X 10 -7 12.055

81.37 7.61 X 10 -8 12.290

81.37 7.74 X 10 -8 12.290

81.10 5.22 X 10 -8 12.230

80.58 4.98 X 10 -8 12.410 -8 12.500 80.00 3.58 X 10

79.65 -8 12.555 3.09 X 10 -8 12.600 79.36 2.71 X 10

79.18 2.50 X 10 -8 12.630 -8 12.650 79.05 1.93 X 10 -8 12.720 78.62 1.52 X 10

78.00 -8 12.820 1.34 X 10

Page 77: Condensation and sublimation of carbon dioxide and water

67

Table VI. (continued)

Temperature Pressure 1000/T. (oK) (Torr) (oK-1)

77.34 7.09 X 10 -9 12.930

77.22 7.92 X 10 -9 12.950

77.04 . -9

8.97 X 10 12.980

77.04 8.96 X 10 -9 12.980

77.04 8,93 X 10 -9 12.980

76.92 8.31 X 10 -9 13.000

76.92 5.13 X 10 -9 13.000

76.92 4.69 X 10-9 13.000

76.92 4.05 X 10-9 13.000

76.92 3.99 X 10-9 13.000

76.86 8.49 X 10 -9 13.011

76.75 4.79 X 10 -9 13.030

76.53 6.00 X 10-9 13.067

76.28 3.99 X 10 -9 13.110

75.93 4.69 X 10 -9 13.170

75.36 3.47 X 10 -9 13.2 70

75.13 4.17 X 10 -9 13.310

75.13 4.14 X 10 --9 13.310

75.13 . -9

3.95 X 10 13.310

75.13 3.42 X 10 -9 13.310

74.91 2.81 X 10 -9 13.349

74.13 9.98 X 10-10 13.490

74.02 1. 32 X 10 -9 13.510

73.53 8.49 X 10-10 13.600

73.10 1.33 X 10 -9 13.680

71.99 8.66 X 10-10 13.891

71.89 8,16 X 10-10 13.910

71.84 6.49 X 10-10 13.920

71.63 5.38 X 10-lQ 13.961

71.58 3.46 X 10-10 13.970

69.69 8.61 X 10-11 13.449

Page 78: Condensation and sublimation of carbon dioxide and water

68

Table VII. Vapor Pressure of H2o

Temperature Pressure 1000/T. (oK) (Torr) (oK-1)

187.02 1.48 X lQ -4 5.347

186.80 1.44 X 10 -4 5.353

182.64 6.91 X 10-5 5.475

176.83 2.33 x lo-5 5.655

174.57 1.49 x lo-5 50 728

169.20 ·5.oo x lo-6 5.910

159.78 5, 78 X 10-7 6.259

159 .58 7.20 X 10-7 6.266

159.50 7.04 X 10- 7 6.270

159.20 4,39 X lQ -7 6.281

159.20 3.95 X lQ -7 6.281

159.00 3,73 X 10 -7 6.289

153.50 1.16 X lQ -7 6.515

153.19 1.33 X lQ -7 6.528

151.10 8.64 X 10 -8 6.618

151.10 8.64 X 10 -8 6.618

151.00 -8 6.623 5, 75 X 10

151.00 -8 6.623 5.75 X 10 -8 6.696 151.00 4.99 X 10

149.34 -8 6.734 3.90 X 10

148.50 -8 6.780 4,70 X lQ

147.50 -8 6.835 2.65 X lQ -8 6 0 835 146 0 30 1.86 X 10 -8 6.835 146.30 1.86 X lQ -8 6.835 146.30 1.58 X 10 -8 6.901 144.90 2.15 X 10 -8 6.901 144.90 2.01 X 10 -8 6.944 144.00 1.05 X 10 -8 6.944 144.00 1.02 X 10 -9 6.944 144.00 9.77 X 10 -9 6.998 142.90 6.67 X 10

Page 79: Condensation and sublimation of carbon dioxide and water

6-9

Table VII. (continued)

Temperature Pressure 1000/T. (oK) (Torr) (oK-1)

142.00 5.59 X 10 -9 7.042

141.10 4.70 X 10 -9 7.087

141.00 4. 42 X 10 -9 7.092

141.00 4.17 X 10 -9 7.092

136.90 2.66 X 10 -9 7.305

134.50 9.28 X 10-lO 7.435

134.50 7.17 X 10-lQ 7.435

131.80 6.33 X 10-lO 7.587

Page 80: Condensation and sublimation of carbon dioxide and water

Table VIII. Constants A, B and H for the Vapor Pressure Curves s of co2 and H20

Pressure H Authors Gas A B s

-1 range (Torr) Cal. mole

These data C02 -4 -9 -3270 23.8 6500 ± 100 3xl0 --10

±50 ±0.4

Tickner & L. (38) C02 10-2--lo-9 -3262 23.7 6480 ± 100 & these data ±50 ±0.4

Honig & Hook (41) C02 10-2--lo-9 -3138 22.8 6236

These data H20 -3 -7 24.0 12170 ± 150 1.5xl0 --10 -6125 ±75 ±0.6

These data H20 10-7--lo-9 -5750 21.7 11430 ± 350 ±180 ±1

Honig & Hook (41) H20 10-3--10-9 -6109 23.9 12200

Page 81: Condensation and sublimation of carbon dioxide and water

N 0 u 1':1:.1 0

110

9

-71

100 90 80

e These Data

Iii Tickner and Lossing Data (38)

Honig and Hook (41)

10 11 12 13

1000/TS (°K-1)

Figure 2'7. Vapor Pressure of co2

Page 82: Condensation and sublimation of carbon dioxide and water

72

180 170 160 150 140

Honig and Hook (41)

5.5 6.0 7.0

Figure 28. Vapor Pressure of H20

Page 83: Condensation and sublimation of carbon dioxide and water

V. CONCLUSION

The condensation coefficient y of co2 and H20 measured in the

range 60°K < T8 < 91°K for co2 and 130°K < TS < 160°K for H2o. In

this range, Y was found to be close to unity, provided the coverage

and the flux intensity ~were sufficient. Apparently this result

should be valid for higher T8 •

A new way of looking at the results is presented. Here, the

variable of interest is the ratio R of the number of molecules that

impinge versus the number of molecules that sublimate.

The temperature of the molecular beam TG is a variable that

affects the condensation coefficient. Additional experiments are

needed to elucidate the relationship between the thermal energy of

73

the molecules impinging and the condensation coefficient. The experi-

ments at low coverages are explained by a model which incorporates

elements of trapping theory and nucleation theory.

The method for measuring the low vapor pressure appears to

be very satisfactory since it is in agreement with the values found

by other methods for higher pressures (38-41).

The values obtained for water are in agreement with the Honig

and Hook (41) extrapolation, except at temperatures below 150°K where

a new structure of ice appears (28). For carbon dioxide the experi-

mental values are lower than predicted by Honig and Hook (41). The

discrepancy increases at lower pressures.

Finally, the values found for the condensation coefficient are

in agreement with the fact that experimentally we find the rate of

Page 84: Condensation and sublimation of carbon dioxide and water

sublimation yields vapor pressures equal to the equilibrium vapor

pressure obtained with other techniques.

74

Page 85: Condensation and sublimation of carbon dioxide and water

VI APPENDIX A

SPATIAL DISTRIBUTION OF C02 AND H2o MOLECULES ON

REFLECTION AND SUBLIMATION FROM A COLD SURFACE

A. Introduction

75

In order to determine the condensation coefficients and sublimation

rates of C02 and H20 molecules at solid surfaces, we needed to known the

spatial distribution of these molecules on reflection and emission.

Evidence has been published (1,5) that reflected and sublimated co2

molecules have a diffuse spatial distribution under the conditions of

our measurements. And a simple trapping model (42) indicates that

reflected co2 and H20 molecules should be initially trapped and then

re-emitted from the surfaces used in our apparatus. The spatial distri-

butions could easily be measured with our experimental set-up. Therefore,

we decided to test the validity of these expectations directly.

The experiment consisted of measuring the fraction of molecules

sublimated and reflected from a solid surface onto several solid

angles. Comparison was then made between the reflected and sublimated

fractions. Predictions of these fractions were also made on the basis

that the diffuse form of the cosine law is obeyed for reflection and

sublimation.

B. Experimental

For these experiments, an effusive molecular beam was used as the

source of gas. This beam was directed towards a quartz crystal micro-

balance and a gold plated copper block. The surface of the copper block

Page 86: Condensation and sublimation of carbon dioxide and water

76

had an RMS roughness of less than sixteen microinches. Both the beam

nozzle and the copper block were equipped with a heater, a platinum

resistance thermometer, and a germanium resistance thermometer. Two

other microbalances were located above the copper block, out of the path

of the molecular beam. Two arrangements of these components were used

as shown in Figure 1 and 2. These figures are drawn to scale. The

copper block, (CB) is 2.54 em in diameter.

-9 The experimental chamber was evacuated to 10 Torr with a liquid

nitrogen trapped, oil diffusion pump. This chamber and its contents

were then cooled to approximately SSK with pumped liquid nitrogen.

co2 and H20 molecules striking a surface at this temperature were

trapped with a probability greater than 0.999.

The dimensions of the molecular beam source were chosen in such

a way that the spatial distribution of molecules leaving the circular 0 0

orifice obeyed the cosine law. (8). Therefore, the ratio Fi = n/n80 0 -2 -1 where n80 is the flux (molecules em sec ) at the source orifice and

0

ni is the flux at a point i on a plane parallel to the orifice, is

given by Lozgachev's formula (10)

(1)

where r is the radius of the source, Li is the distance to the plane

along a line normal to the plane of the source, and Si is the distance

from the point to a line passing through the center of the source and

pe.rpendicular to the plane of the source.

Page 87: Condensation and sublimation of carbon dioxide and water

When the surface on which the molecules impinge is not infinite­

simally small, the mean value of F is given by

(2)

where dAi is an area over which Fi is practically constant and A is

the total area to which F applies. F is called the shape factor.

77

Using the various distances Li and Si of the components in the

experimental chamber, we calculated the shape factor F for the beam

orifice to the microbalance BM, F' for the beam orifice to the surface

of the copper block CB, and Fu for the surface of CB to the microbalance

CR. To calculate F" it was assumed that the SJ>atial distribution of

molecules leaving the surface of CB obeyed the cosine law.

The chamber wall and microbalances BM and CR were held to tempera-0

tures below 55K. The measured flux nBM on microbalance BM was used to 0

calculate the average flux nCB on the surface of CB from the relation

(3)

Our first d i 1 1 Cm- 2 on the experiment was to epos t nCB mo ecu es

2 4 The quantity nCB corresponded to between 10 and 10 copper block.

molecular layers. During this deposition, CB was at or below 55°K.

CB was then slowly heated until all the gas was evaporated from its

surface. The frequency change of CR gave the population density

change nCR molecules cm-2 caused by the sublimation of gas from CB.

Since

;,, ::,:.:.

Page 88: Condensation and sublimation of carbon dioxide and water

78

n = Fn nCB CR S (4)

from Eqs. 3 and 4, one has

(5)

where the subscript S refers to sublimation. Our measurements of

nCR and nCB therefore gave a direct measure of RS' which we call the

spatial distribution factor for sublimation. A similar set of measure-

ments were obtained using the microbalance BR indicated in Figs. 1 and

2. These measurements gave Rs', where

F'F "' s R ' = s F

and F '" is the shape factor for sublimation from CB to BR. s

(6)

Our second experiment was to heat the copper block to a temperature

TCB at which no measurable condensation occurred. For these experi-

ments, 90K ~ TCB ~ 210K and for C02 and 160K ~ TCB ~ 200K for H20.

Under these conditions, the rate of change of frequency of the CR and

BM microbalance became immeasurably small within a second after the

molecular beam was turned off. However, with the beam on, the flux of

molecules at CR was

0 (7)

F

where F " is the shape factor for reflection from CB to CR. R

Similarly,

0

~ • lit' ~M (8)

Page 89: Condensation and sublimation of carbon dioxide and water

79

where FR "' is the shape factor for reflection from CB to BM.

For the reflection measurements, the molecular beam temperature

ranged from 135 to 210K for co2 and from 200 to 240K for H2o. The 0

value of nCB was varied from 5 x 1013 to 1016 molecules cm-2 sec-1 •

Determination of R8 ' and~· was not made for the geometry shown in

Fig. 1.

C. Results and Discussion

For a fixed geometry, we found that R8 =~and~·=~' within 0

± 2% f 11 d or a measure values of nCB and TCB. Experimentally, R8 , R8 ',

~ and ~' differed from their computed values by about 15% assuming

the diffuse cosine law spatial distribution.

The expected error in our calculated values of spatial distribution

factors was ± 20%. This was due to the accumulated errors in measur-

ing the locations of the various surfaces in the experimental chamber

during the assembly process. Therefore, it is our conclusion that,

under the conditions of our experiment, the spatial distribution of

reflected and sublimated molecules of C02 and H20 obeys the diffuse

cosine law.

Because the molecule-surface interaction energies of C02 (44) and

H20 (45-47) are appreciable, the surface trapping of these gases on

low temperature surfaces is highly probable. One measure of the

probability of trapping and reemission is the accommodation coefficient.

On the basis of a simple model of trapping, (5) it is expected that

both co2 and H20 should have accommodation coefficients near unity on

low temperature surfaces. This has been found to be the case for co2

(48) and for H20 (49-50) on surfaces saturated with these gases. It

Page 90: Condensation and sublimation of carbon dioxide and water

80

is therefore likely that the "reflection" process for H20 and co2 on

cold surfaces is actually a trapping-evaporation process. This would

provide a simple explanation to the identical spatial distribution

found for reflected and sublimated molecules of H20 and co2 •

Page 91: Condensation and sublimation of carbon dioxide and water

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Page 94: Condensation and sublimation of carbon dioxide and water

VITA

Victor Cazcarra was born on March 8, 1945 in Saint-Laurent de

Neste (65), France. He received his primary and secondary education at

the "Lycee" of Saint-Gaudens (31), from which he s:-aduated with honors

in the yearl963. After two years of preparation at the "Lycee Pierre

de Fermat" he entered the Advanced School of Chemistry in Bordeaux,

from which he received the "Licence-es-Sciences" in the year 1967, and

the "Maitrise" in the year 1968. Later, he worked one year as a

scientist in the Research Center of Saclay, France.

From September 1969 to May 1972, he was enrolled in the Graduate

School of the University of Missouri-Rolla, where he held a research

assistantship in the Graduate Center for Cloud Physics Research.