Quasi-relativistic modeltotential approach. Spin-orbit effects on energies and geometries of several di- and tri-atomic molecules
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference16 articles.
1. Ab initio effective core potentials including relativistic effects. III. Ground state Au2 calculations
2. Ab initio effective core potentials including relativistic effects. V. SCF calculations with ω–ω coupling including results for Au2+, TlH, PbS, and PbSe
3. Electronic structure for the ground state of TlH from relativistic multiconfiguration SCF calculations
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