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0541366 - ÚOCHB 2022 RIV US eng J - Journal Article
Kříž, Kristian - Nováček, M. - Řezáč, Jan
Non-Covalent Interactions Atlas Benchmark Data Sets 3: Repulsive Contacts.
Journal of Chemical Theory and Computation. Roč. 17, č. 3 (2021), s. 1548-1561. ISSN 1549-9618. E-ISSN 1549-9626
R&D Projects: GA ČR(CZ) GA19-13905S; GA MŠMT(CZ) EF16_019/0000729
Institutional support: RVO:61388963
Keywords : non-covalent interactions * benchmark data set * CCSD(T) * repulsive contacts * Pauli repulsion
OECD category: Physical chemistry
Impact factor: 6.578, year: 2021
Method of publishing: Limited access
https://doi.org/10.1021/acs.jctc.0c01341
Permanent Link: http://hdl.handle.net/11104/0318928