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1 Ergebnisse
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Quasi-Relativistic Calculation of EPR g Tensors with Deriva..:
Franzke, Yannick J.
;
Yu, Jason M.
Journal of Chemical Theory and Computation. 18 (2022) 4 - p. 2246-2266 , 2022
Link:
https://doi.org/10.1021/acs.jctc.1c01175
RT Journal T1 <Title>Quasi-Relativistic Calculation of EPR g Tensors with Derivatives of the Decoupling Transformation, Gauge-Including Atomic Orbitals, and Magnetic Balance</Title> UL https://suche.suub.uni-bremen.de/peid=cr-10.1021_acs.jctc.1c01175&Exemplar=1&LAN=DE A1 Franzke, Yannick J. A1 Yu, Jason M. PB American Chemical Society (ACS) YR 2022 SN 1549-9618 SN 1549-9626 JF Journal of Chemical Theory and Computation VO 18 IS 4 SP 2246 OP 2266 LK http://dx.doi.org/https://doi.org/10.1021/acs.jctc.1c01175 DO https://doi.org/10.1021/acs.jctc.1c01175 SF ELIB - SuUB Bremen
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