Published November 1, 1979
| Version v1
Journal article
Finite-field MC SCF study of the hydrogen molecule polarizability
Creators
- 1. Polska Akademia Nauk, Warsaw. Inst. Chemii Organicznej
- 2. Kemicentrum, Lund (Sweden)
Description
The polarizability of the H2 molecule is computed using the finite-field method and relatively simple multiconfiguration SCF wavefunctions. Analysing the dependence of the polarizability on the internuclear distance it is shown that within the chosen approximation the correlation contributions to the polarizability can be estimated when they become significant. (Auth.)
Additional details
Publishing Information
- Journal Title
- Chem. Phys. Lett.
- Journal Volume
- 67
- Journal Issue
- 1
- Series
- Chem. Phys. Lett.
- Journal Page Range
- 189-191
- ISSN
- 0009-2614
INIS
- Country of Publication
- Netherlands
- Country of Input or Organization
- Netherlands
- INIS RN
- 11532650
- Subject category
- S74: ATOMIC AND MOLECULAR PHYSICS;
- Descriptors DEI
- HYDROGEN; INTERATOMIC DISTANCES; MOLECULES; PERTURBATION THEORY; POLARIZABILITY; SELF-CONSISTENT FIELD; WAVE FUNCTIONS
- Descriptors DEC
- DISTANCE; ELECTRICAL PROPERTIES; ELEMENTS; FUNCTIONS; NONMETALS; PHYSICAL PROPERTIES