Energy gradient for local wavefunctions
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference31 articles.
1. Floating Spherical Gaussian Orbital Model of Molecular Structure. I. Computational Procedure. LiH as an Example
2. Floating Spherical Gaussian Orbital Model of Molecular Structure. II. One‐ and Two‐Electron‐Pair Systems
3. Bonding in acyclic hydrocarbons. An FSGO analysis and computational procedure
4. Ab initio calculations on large molecules using molecular fragments. Evaluation and extension of initial procedures
5. A Floating spherical Gaussian orbital model of molecular structure. III. First-row atom hydrides
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1. An improved localized molecular-orbital assembler approach for Hartree–Fock calculations of general large molecules;Chemical Physics Letters;2012-06
2. The split-valence bond-orbital method and an application to the ground states of the first-row hydrides;Journal of Molecular Structure: THEOCHEM;1987-06
3. The scope for small Gaussian bases in molecular energy calculation;Theoretical and Experimental Chemistry;1984
4. Model MG-FSGO calculations of short range interactions;Journal of Molecular Structure: THEOCHEM;1983-07
5. Model MG-FSGO calculations of short range interactions;Journal of Molecular Structure;1983-01
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