"Analytical energy gradient evaluation in relativistic and nonrelativistic ..."

Fan Wang, Lemin Li (2002)

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DOI: 10.1002/JCC.10082

access: closed

type: Journal Article

metadata version: 2020-05-30

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Fan Wang, Lemin Li:
Analytical energy gradient evaluation in relativistic and nonrelativistic density functional calculations. J. Comput. Chem. 23(9): 920-927 (2002)

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