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Title Off-center gaussian functions, an alternative atomic orbital basic set for accurate noncovalent interaction calculations of large systems Author Melicherčík M. SAVVS - Výpočtové stredisko SAV Co-authors Pitoňák Michal SAVVS - Výpočtové stredisko SAV Kello V. SAVVS - Výpočtové stredisko SAV Hobza Pavel SAVVS - Výpočtové stredisko SAV Neogrády Pavel SAVVS - Výpočtové stredisko SAV Source document Journal of Chemical Theory and Computation. Vol. 9 (2013), p. 5296 Category ADCA - Scientific papers in foreign journals registered in Current Contents Connect with IF (impacted) Category of document (from 2022) V3 - Vedecký výstup publikačnej činnosti z časopisu Type of document článok Year 2013 DOI 10.1021/ct400692b 
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Title Parallelized implementation of the CCSD(T) method in MOLCAS using optimized virtual orbitals space and Cholesky decomposed two-electron integrals Author Pitoňák Michal Co-authors Aquilante Francesco Hobza Pavel Neogrády Pavel Noga Jozef 1955 SAVANOCH - Ústav anorganickej chémie SAV Urban Miroslav Source document Collection of Czechoslovak Chemical Communications. Vol. 76, no. 6 (2011), p. 713-742 Category ADCA - Scientific papers in foreign journals registered in Current Contents Connect with IF (impacted) Category of document (from 2022) V3 - Vedecký výstup publikačnej činnosti z časopisu Type of document článok Year 2011 DOI 10.1135/cccc2011048 article