Published February 15, 1975 | Version v1
Journal article Metadata-only

Non-orthogonal atomic orbitals

Creators

  • 1. Loyola Univ., New Orleans

Description

The procedure of Raffenetti and Ruedenberg for defining non-orthogonal atomic orbitals is generalized to provide minimum-kinetic-energy atomic orbitals for use in applications of pseudopotential theory in atoms and molecules. (U.S.)

Additional details

Additional titles

Augmented title (English)
Raffenetti and Ruedenberg procedure

Identifiers

DOI
10.1016/0009-2614(75)80080-7;

Publishing Information

Journal Title
Chemical Physics Letters
Journal Volume
31
Journal Issue
1
Series
Chem. Phys. Lett.
Journal Page Range
154-156
ISSN
0009-2614

INIS

Country of Publication
United States
Country of Input or Organization
United States
INIS RN
6213994
Subject category
S74: ATOMIC AND MOLECULAR PHYSICS;
Descriptors DEI
ATOMIC MODELS; ELECTRONIC STRUCTURE; SLATER METHOD
Descriptors DEC
MATHEMATICAL MODELS

Optional Information

Notes
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