Verbesserung von SCF-Bildungsenthalpien mit einer beschr�nkten Konfigurationswechselwirkung
Author:
Publisher
Springer Science and Business Media LLC
Subject
Chiropractics,Physical and Theoretical Chemistry
Link
http://link.springer.com/content/pdf/10.1007/BF00548479.pdf
Reference33 articles.
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1. Ab initio calculations of all-transoctatetraene and eight isoelectronic conjugated chains: Semiempirical heats of formation and stabilization energies;International Journal of Quantum Chemistry;1992-01-20
2. Empirical resonance energies for benzene and pyridine;Tetrahedron Letters;1985-01
3. Interaction-optimized virtual orbitals, I. External double excitations;Chemical Physics;1985-01
4. Thermochemical data fromab initiocalculations. II. Total correlation energies, Schrödinger energies, and theoretical heats of formation;Journal of Computational Chemistry;1982-06
5. Energy surface calculations for the reaction HF + H+ ⇌ HFH+;Chemical Physics Letters;1976-05
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