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1 Ergebnisse
1
Fragment-Based Restricted Active Space Configuration Intera..:
Lin, Hung-Hsuan
;
Maschio, Lorenzo
;
Kats, Daniel
..
Journal of Chemical Theory and Computation. 16 (2020) 11 - p. 7100-7108 , 2020
Link:
https://doi.org/10.1021/acs.jctc.0c00576
RT Journal T1 <Title>Fragment-Based Restricted Active Space Configuration Interaction with Second-Order Corrections Embedded in Periodic Hartree–Fock Wave Function</Title> UL https://suche.suub.uni-bremen.de/peid=cr-10.1021_acs.jctc.0c00576&Exemplar=1&LAN=DE A1 Lin, Hung-Hsuan A1 Maschio, Lorenzo A1 Kats, Daniel A1 Usvyat, Denis A1 Heine, Thomas PB American Chemical Society (ACS) YR 2020 SN 1549-9618 SN 1549-9626 JF Journal of Chemical Theory and Computation VO 16 IS 11 SP 7100 OP 7108 LK http://dx.doi.org/https://doi.org/10.1021/acs.jctc.0c00576 DO https://doi.org/10.1021/acs.jctc.0c00576 SF ELIB - SuUB Bremen
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