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Reference MP2/CBS and CCSD(T) quantum-chemical calculations on stacked adenine dimers. Comparison with DFT-D, MP2.5, SCS(MI)-MP2, M06-2X, CBS(SCS-D) and force field descriptions

SYSNO	0345379
Title	Reference MP2/CBS and CCSD(T) quantum-chemical calculations on stacked adenine dimers. Comparison with DFT-D, MP2.5, SCS(MI)-MP2, M06-2X, CBS(SCS-D) and force field descriptions
Author(s)	Morgado, Claudio A. (BFU-R) Jurečka, P. (CZ) Svozil, D. (CZ) Hobza, P. (CZ) Šponer, Jiří (BFU-R)_{RID, ORCID}
Source Title	Physical Chemistry Chemical Physics. Roč. 12, č. 14 (2010), s. 3522-3534. - : Royal Society of Chemistry
Document Type	Článek v odborném periodiku
Grant	IAA400040802 GA AV ČR - Academy of Sciences of the Czech Republic (AV ČR), CZ - Czech Republic
	GA203/09/1476 GA ČR - Czech Science Foundation (CSF), CZ - Czech Republic
	LC06030 GA MŠMT - Ministry of Education, Youth and Sports (MEYS), CZ - Czech Republic
	LC512, CZ - Czech Republic
CEZ	AV0Z50040507 - BFU-R (2005-2011)
	AV0Z50040702 - BFU-R (2007-2013)
Language	eng
Country	GB
Keywords	quantum chemistry * stacking * force field
Permanent Link	http://hdl.handle.net/11104/0186660

Number of the records: 1