화학공학소재연구정보센터
검색결과 : 4건
No. Article
1 Solvent effects on the spectroscopic properties of Damascone derivatives: A sequential Monte Carlo/Quantum Mechanics study
de Almeida AR, Oliveira LBA, Colherinhas G
Chemical Physics Letters, 730, 531, 2019
2 GIAO-DFT isotropic magnetic shielding constants and spin-spin coupling of tartaric acid in water solution
Fideles B, Oliveira LBA, Colherinhas G
Chemical Physics Letters, 644, 205, 2016
3 Spectroscopic properties of vitamin E models in solution
Oliveira LBA, Colherinhas G, Fonseca TL, Castro MA
Chemical Physics Letters, 628, 49, 2015
4 A sequential MC/TD-DFT study of the solvatochromic shift of the pyridinium-N-phenoxide betaine dye in water using standard and long-range corrected functionals
Oliveira LBA, Fonseca TL, Coutinho K, Canuto S
Chemical Physics Letters, 514(4-6), 251, 2011