Home / Publications / Simulation of the isomerization of an anionic hydroxo complex of rhodium(V)

Simulation of the isomerization of an anionic hydroxo complex of rhodium(V)

Alexey Vital'evich Avdei 1
Alexey Vital'evich Avdei
, 
Aleksandr Yuryevich Ermilov 1
Aleksandr Yuryevich Ermilov
, 
Vladimir Dmitrievich Dolzhenko 1
Vladimir Dmitrievich Dolzhenko
, 
Yurii Mikhailovich Kiselev 1
Yurii Mikhailovich Kiselev
10.1070/MC2005v015n02ABEH002052
Published 2005-05-23
Communication , Volume 15, Issue 2, 81-83
1
Share
Cite this
GOST
 | 
Cite this
GOST Copy
Avdei A. V. et al. Simulation of the isomerization of an anionic hydroxo complex of rhodium(V) // Mendeleev Communications. 2005. Vol. 15. No. 2. pp. 81-83.
GOST all authors (up to 50) Copy
Avdei A. V., Ermilov A. Y., Dolzhenko V. D., Kiselev Y. M. Simulation of the isomerization of an anionic hydroxo complex of rhodium(V) // Mendeleev Communications. 2005. Vol. 15. No. 2. pp. 81-83.
RIS
 | 
Cite this
RIS Copy
TY - JOUR
DO - 10.1070/MC2005v015n02ABEH002052
UR - https://mendcomm.colab.ws/publications/10.1070/MC2005v015n02ABEH002052
TI - Simulation of the isomerization of an anionic hydroxo complex of rhodium(V)
T2 - Mendeleev Communications
AU - Avdei, Alexey Vital'evich
AU - Ermilov, Aleksandr Yuryevich
AU - Dolzhenko, Vladimir Dmitrievich
AU - Kiselev, Yurii Mikhailovich
PY - 2005
DA - 2005/05/23
PB - Mendeleev Communications
SP - 81-83
IS - 2
VL - 15
ER -
BibTex
 | 
Cite this
BibTex (up to 50 authors) Copy
@article{2005_Avdei,
author = {Alexey Vital'evich Avdei and Aleksandr Yuryevich Ermilov and Vladimir Dmitrievich Dolzhenko and Yurii Mikhailovich Kiselev},
title = {Simulation of the isomerization of an anionic hydroxo complex of rhodium(V)},
journal = {Mendeleev Communications},
year = {2005},
volume = {15},
publisher = {Mendeleev Communications},
month = {May},
url = {https://mendcomm.colab.ws/publications/10.1070/MC2005v015n02ABEH002052},
number = {2},
pages = {81--83},
doi = {10.1070/MC2005v015n02ABEH002052}
}
MLA
Cite this
MLA Copy
Avdei, Alexey Vital'evich, et al. “Simulation of the isomerization of an anionic hydroxo complex of rhodium(V).” Mendeleev Communications, vol. 15, no. 2, May. 2005, pp. 81-83. https://mendcomm.colab.ws/publications/10.1070/MC2005v015n02ABEH002052.

Abstract

The molecular ion Rh(OH)6− was simulated, and the occurrence of a great number of isomers with symmetry no higher than Ci was found.

References

1.
10.1070/MC2005v015n02ABEH002052_bib1
Shubin
Kinet. Katal., 1978
2.
General atomic and molecular electronic structure system
Schmidt M.W., Baldridge K.K., Boatz J.A., Elbert S.T., Gordon M.S., Jensen J.H., Koseki S., Matsunaga N., Nguyen K.A., Su S., Windus T.L., Dupuis M., Montgomery J.A.
Journal of Computational Chemistry, 1993
3.
A. A. Granovsky, http://classic.chem.msu.su/gran/gamess/index.html
5.
Effective Potentials in Molecular Quantum Chemistry
Krauss M., Stevens W.J.
Annual Review of Physical Chemistry, 1984
7.
An algorithm for the location of transition states
Baker J.
Journal of Computational Chemistry, 1986
8.
Reaction path following in mass-weighted internal coordinates
Gonzalez C., Schlegel H.B.
The Journal of Physical Chemistry, 1990
9.
10.1070/MC2005v015n02ABEH002052_bib9
Stepanov
Sorosovskii Obrazovatel’nyi Zhurnal, 2001
12.
Ab initio energy-adjusted pseudopotentials for elements of groups 13–17
Bergner A., Dolg M., Küchle W., Stoll H., Preuß H.
Molecular Physics, 1993
13.
Self‐consistent molecular orbital methods. XX. A basis set for correlated wave functions
Krishnan R., Binkley J.S., Seeger R., Pople J.A.
Journal of Chemical Physics, 1980