Generation, contraction, and polarisation of Gaussian basis sets for atomicandmolecular calculations using the generator coordinate method with polynomial discretisation: atoms from Na through Cl
Amanda Ribeiro Guimaraes Rugles C Barbosa; Ana Cristina Mora Tello; Aldineia Pereira da Silva; Júlia M. A Alves; Milena Palhares Maringolo; Alberico Borges Ferreira da Silva
Physical Chemistry Chemical Physics Cambridge: Royal Society of Chemistry v. 23, 16989, 2021 online
Cambridge 2021
Localização:
IQSC - Inst. Química de São Carlos
(P19495 )(Acessar)