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Regularized CASPT2: an Intruder-State-Free Approach:
Battaglia, Stefano
;
Fransén, Lina
;
Fdez. Galván, Ignacio
.
Journal of Chemical Theory and Computation. 18 (2022) 8 - p. 4814-4825 , 2022
Link:
https://doi.org/10.1021/acs.jctc.2c00368
RT Journal T1 <Title>Regularized CASPT2: an Intruder-State-Free Approach</Title> UL https://suche.suub.uni-bremen.de/peid=cr-10.1021_acs.jctc.2c00368&Exemplar=1&LAN=DE A1 Battaglia, Stefano A1 Fransén, Lina A1 Fdez. Galván, Ignacio A1 Lindh, Roland PB American Chemical Society (ACS) YR 2022 SN 1549-9618 SN 1549-9626 JF Journal of Chemical Theory and Computation VO 18 IS 8 SP 4814 OP 4825 LK http://dx.doi.org/https://doi.org/10.1021/acs.jctc.2c00368 DO https://doi.org/10.1021/acs.jctc.2c00368 SF ELIB - SuUB Bremen
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