Dicarba-<i>nido-</i>undecaborates: topological analysis
Calculations of parameters of function of full electron density in molecules of dicarba-nido-undecaborates were carried out by the first order Promega method using MP2(full)/6-311++G(2d,p) level of theory. The features of electron structure of undecaborates and the relation of parameters of function...
Saved in:
Main Authors: | S. P. Knyazev, E. G. Gordeev, A. Yu. Kostyukovitch, A. Yu. Shkulipa |
---|---|
Format: | Article |
Language: | Russian |
Published: |
MIREA - Russian Technological University
2011-12-01
|
Series: | Тонкие химические технологии |
Subjects: | |
Online Access: | https://www.finechem-mirea.ru/jour/article/view/1184 |
Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
Similar Items
-
Rearrangements of dicarba-<i>nido-</i>undecaborates
by: S. P. Knyazev, et al.
Published: (2011-10-01) -
Thermodynamic stability of isomers of mono- and dianions of dicarba-nido-undecaborates
by: S. P. Knyazev, et al.
Published: (2011-08-01) -
SIMULATION OF ELECTRONIC AND MAGNETIC PROPERTIES OF LOW-DIMENSIONAL MATERIALS WITH USE OF FIRST PRINCIPLES METHODS
by: M. S. Zelenina, et al.
Published: (2019-06-01) -
L' educazione STEM al nido: una sfida possibile
by: Nicoletta Rosati
Published: (2021-12-01) -
Quantum-chemical study of carborane(12) rearrangement mechanisms
by: A. Yu. Shkulipa, et al.
Published: (2013-02-01)