Journal of Physical Chemistry B, volume 101, issue 41, pages 8180-8190

Calculated Properties of Ag Clusters on Silver Halide Cubic Surface Sites

R. C. BAETZOLD 1
1
 
Imaging Research and Advanced Development, Eastman Kodak Company, Rochester, New York 14650-2021
Publication typeJournal Article
Publication date1997-10-01
Quartile SCImago
Q1
Quartile WOS
Q3
Impact factor3.3
ISSN15206106, 15205207
Materials Chemistry
Surfaces, Coatings and Films
Physical and Theoretical Chemistry
Abstract
The ionic and electronic steps in the initial photolysis of silver halide to form silver clusters have been analyzed by a combination of classical and quantum mechanical procedures. We have applied Hartree−Fock and local density methods to the problem and included treatment of the long-range lattice polarization. It is found that the electron-accepting and hole-accepting levels of these clusters depend strongly upon their site of adsorption. The positive kink is a favorable site for growth where electrons from the conduction band can be trapped prior to neutralization by interstitial silver ions. It is shown that relaxation of the cluster geometry following electron capture is an important means of deepening the electron trapping level. Hole trapping is possible at some of these clusters, leading to a reduction in their size. Overall, the picture that emerges is consistent with the generally accepted nucleation and growth mechanism of photolysis.

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BAETZOLD R. C. Calculated Properties of Ag Clusters on Silver Halide Cubic Surface Sites // Journal of Physical Chemistry B. 1997. Vol. 101. No. 41. pp. 8180-8190.
GOST all authors (up to 50) Copy
BAETZOLD R. C. Calculated Properties of Ag Clusters on Silver Halide Cubic Surface Sites // Journal of Physical Chemistry B. 1997. Vol. 101. No. 41. pp. 8180-8190.
RIS |
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RIS Copy
TY - JOUR
DO - 10.1021/jp971625v
UR - https://doi.org/10.1021/jp971625v
TI - Calculated Properties of Ag Clusters on Silver Halide Cubic Surface Sites
T2 - Journal of Physical Chemistry B
AU - BAETZOLD, R. C.
PY - 1997
DA - 1997/10/01 00:00:00
PB - American Chemical Society (ACS)
SP - 8180-8190
IS - 41
VL - 101
SN - 1520-6106
SN - 1520-5207
ER -
BibTex |
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BibTex Copy
@article{1997_BAETZOLD,
author = {R. C. BAETZOLD},
title = {Calculated Properties of Ag Clusters on Silver Halide Cubic Surface Sites},
journal = {Journal of Physical Chemistry B},
year = {1997},
volume = {101},
publisher = {American Chemical Society (ACS)},
month = {oct},
url = {https://doi.org/10.1021/jp971625v},
number = {41},
pages = {8180--8190},
doi = {10.1021/jp971625v}
}
MLA
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MLA Copy
BAETZOLD, R. C.. “Calculated Properties of Ag Clusters on Silver Halide Cubic Surface Sites.” Journal of Physical Chemistry B, vol. 101, no. 41, Oct. 1997, pp. 8180-8190. https://doi.org/10.1021/jp971625v.
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