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Coupled cluster and MBPT study of nickel states

โœ Scribed by E.A. Salter; L. Adamowicz; Rodney J. Bartlett


Book ID
103028388
Publisher
Elsevier Science
Year
1985
Tongue
English
Weight
412 KB
Volume
122
Category
Article
ISSN
0009-2614

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๐Ÿ“œ SIMILAR VOLUMES


Coupled-cluster, unitary coupled-cluster
โœ John D. Watts; Gary W. Trucks; Rodney J. Bartlett ๐Ÿ“‚ Article ๐Ÿ“… 1989 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 614 KB

We report open-shell analytical gradient methods and results for the high-level many-body methods, full fourth-order MBPT, coupled-cluster doubles, and the recently proposed unitary coupled-cluster method. Examples include vibrational frequencies and dipole moments of 'B, CH,, 2B, NH2, and 'B, SiH,