State-of-the-art computations of dipole moments using analytic gradients of high-level density-fitted coupled-cluster methods with focal-point approximations

par Bozkaya, Uğur
Publié dans: Journal of computational chemistry (2020)

Assessment of the orbital-optimized coupled-electron pair theory for thermochemistry and kinetics improving on CCSD and CEPA(1)

par Soydaş, Emine
Publié dans: Journal of computational chemistry (2014)