Browse Collection: Ru_CD
https://iochem-bd.bsc.es/browse/handle/100/216898
Ru_CD2024-03-28T11:41:09Z1a
https://iochem-bd.bsc.es/browse/handle/100/216902
Title: 1a
Authors: Novotny, Jan
Description: trans-RuCl4(4-COOHPy)2: 2c calculation of g-tensor (SO-ZORA/PBE0/TZ2P/COSMO), evaluation of hyperfine shift on H atoms of bound cyclodextrines (alpha, beta and gamma) in specified orientation using point-dipol approximation2022-08-16T18:56:03Z3a
https://iochem-bd.bsc.es/browse/handle/100/216901
Title: 3a
Authors: Novotny, Jan
Description: trans-RuCl4(4-COOHPy)DMSO: 2c calculation of g-tensor (SO-ZORA/PBE0/TZ2P/COSMO), evaluation of hyperfine shift on H atoms of bound beta-cyclodextrines using point-dipol approximation2022-08-16T18:55:59Z5a
https://iochem-bd.bsc.es/browse/handle/100/216900
Title: 5a
Authors: Novotny, Jan
Description: trans-Ru(oxalate)2(4-COOHPy)2: 2c calculation of g-tensor (SO-ZORA/PBE0/TZ2P/COSMO), evaluation of hyperfine shift on H atoms of bound beta-cyclodextrines in head orientation using point-dipol approximation2022-08-16T18:55:54Z5b
https://iochem-bd.bsc.es/browse/handle/100/216899
Title: 5b
Authors: Novotny, Jan
Description: trans-Ru(oxalate)2(4-MePy)2: 2c calculation of g-tensor (SO-ZORA/PBE0/TZ2P/COSMO), evaluation of hyperfine shift on H atoms of bound gamma-cyclodextrines using point-dipol approximation2022-08-16T18:55:48Z