화학공학소재연구정보센터
검색결과 : 3건
No. Article
1 Segmented all-electron Gaussian basis sets of double and triple zeta qualities for Fr, Ra, and Ac
Campos CT, de Oliveira AZ, Ferreira IB, Jorge FE, Martins LSC
Chemical Physics Letters, 675, 1, 2017
2 GAUSSIAN basis set of sextuple zeta quality for hydrogen through argon
Campos CT, Ceolin GA, Neto AC, Jorge FE, Pansini FNN
Chemical Physics Letters, 516(4-6), 125, 2011
3 Basis set convergence on optical rotation DFT calculations
Campos CT, Jorge FE, Silva TP, Coppo MR
Chemical Physics Letters, 494(4-6), 170, 2010