AccurateAb InitioCalculation of Ionization Potentials of the First-Row Transition Metals with the Configuration-Interaction Quantum Monte Carlo Technique-Reference-Cited by-同舟云学术

AccurateAb InitioCalculation of Ionization Potentials of the First-Row Transition Metals with the Configuration-Interaction Quantum Monte Carlo Technique

Published:2015-01-21 Issue:3 Volume:114 Page:
ISSN:0031-9007
Container-title:Physical Review Letters
language:en
Short-container-title:Phys. Rev. Lett.

Author:

Thomas Robert E.,Booth George H.,Alavi Ali

Funder

Trinity College, University of Cambridge

Royal Society

Engineering and Physical Sciences Research Council

Publisher

American Physical Society (APS)

Subject

General Physics and Astronomy

Link

http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevLett.114.033001/fulltext

Reference46 articles.

1. Perturbation calculation of atomic correlation energies for the first transition period

2. Valence correlation in the s2dn, sdn+1, and dn+2 states of the first‐row transition metal atoms

3. On correlation in the first row transition metal atoms

4. The atomic states of nickel

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