The Cr2 potential energy curve studied with multiconfigurational second-order perturbation theory
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference20 articles.
1. f-Type functions in the orbital basis for calculating molecular interactions involving d electrons Cr2 and Mo2
2. Theoretical evidence for multiple 3d bondig in the V2 and Cr2 molecules
3. Modified Generalized Valence-Bond Method: A Simple Correction for the Electron Correlation Missing in Generalized Valence-Bond Wave Functions; Prediction of Double-Well States forCr2andMo2
4. Negative ion photoelectron spectroscopy of chromium dimer
5. Analytic evaluation of energy gradients for the singles and doubles coupled cluster method including perturbative triple excitations: Theory and applications to FOOF and Cr2
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