Massively parallel spin–orbit configuration interaction-Reference-Cited by-同舟云学术

Massively parallel spin–orbit configuration interaction

Published:2014-08-22 Issue:10 Volume:133 Page:
ISSN:1432-881X
Container-title:Theoretical Chemistry Accounts
language:en
Short-container-title:Theor Chem Acc

Author:

Tilson Jeffrey L.,Ermler Walter C.

Publisher

Springer Science and Business Media LLC

Subject

Physical and Theoretical Chemistry

Link

http://link.springer.com/content/pdf/10.1007/s00214-014-1564-8.pdf

Reference48 articles.

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3. Dolg M, Wedig U, Stoll H, Preuss H (1987) Ab initio pseudopotential study of the first row transition metal monoxides and iron monohydride. J Chem Phys 86(4):2123–2131

4. Sjøvoll M, Gropen O, Olsen J (1997) A determinantal approach to spin-orbit configuration interaction. Theor Chem Acc 97(1):301–312. doi: 10.1007/s002140050265

5. Liu W, Dolg M (1998) Benchmark calculations for lanthanide atoms: calibration of ab initio and density-functional methods. Phys Rev A 57(3):1721–1728

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