Integrals for non-Born–Oppenheimer calculations of molecules with three nuclei
Author:
Publisher
Informa UK Limited
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics
Link
http://www.tandfonline.com/doi/pdf/10.1080/00268970512331339314
Reference11 articles.
1. Bubin S Bednarz E Adamowicz L Submitted
2. Non-Born–Oppenheimer calculations of atoms and molecules
3. Nonrelativistic molecular quantum mechanics without approximations: Electron affinities of LiH and LiD
4. Non-Born–Oppenheimer study of positronic molecular systems: e+LiH
5. A correlated basis set for nonadiabatic energy calculations on diatomic molecules
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2. Treating the motion of nuclei and electrons in atomic and molecular quantum mechanical calculations on an equal footing: Non-Born–Oppenheimer quantum chemistry;Chemical Physics and Quantum Chemistry;2020
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