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1 Ergebnisse
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Assessing the Interplay between Functional-Driven and Densi..:
Palos, Etienne
;
Lambros, Eleftherios
;
Swee, Steven
...
Journal of Chemical Theory and Computation. 18 (2022) 6 - p. 3410-3426 , 2022
Link:
https://doi.org/10.1021/acs.jctc.2c00050
RT Journal T1 <Title>Assessing the Interplay between Functional-Driven and Density-Driven Errors in DFT Models of Water</Title> UL https://suche.suub.uni-bremen.de/peid=cr-10.1021_acs.jctc.2c00050&Exemplar=1&LAN=DE A1 Palos, Etienne A1 Lambros, Eleftherios A1 Swee, Steven A1 Hu, Jie A1 Dasgupta, Saswata A1 Paesani, Francesco PB American Chemical Society (ACS) YR 2022 SN 1549-9618 SN 1549-9626 JF Journal of Chemical Theory and Computation VO 18 IS 6 SP 3410 OP 3426 LK http://dx.doi.org/https://doi.org/10.1021/acs.jctc.2c00050 DO https://doi.org/10.1021/acs.jctc.2c00050 SF ELIB - SuUB Bremen
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