Photodissociation of bromobenzene in solution

Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen

Thom H. Dunning · The Journal of Chemical Physics · 1989 · 31.7K citations

Natural Sciences, Chemistry, Physics +17

A complete active space SCF method (CASSCF) using a density matrix formulated super-CI approach

Björn O. Roos, Peter R. Taylor, Per E.M. Sigbahn · Chemical Physics · 1980 · 4K citations

Computing, Computer Science, Scientific Computing +7

Second-order perturbation theory with a complete active space self-consistent field reference function

Kerstin Andersson, Per‐Åke Malmqvist, Björn O. Roos · The Journal of Chemical Physics · 1992 · 3.9K citations

Natural Sciences, Chemistry, Physics +12

The multi-state CASPT2 method

James P. Finley, Per‐Åke Malmqvist, Björn O. Roos et al. · Chemical Physics Letters · 1998 · 1.5K citations

Natural Sciences, Chemistry, Computer Science +6

The <i>ab</i><i>initio</i> model potential method. Cowan–Griffin relativistic core potentials and valence basis sets from Li (<i>Z</i> = 3) to La (<i>Z</i> = 57)

Zoila Barandiarán, Luis Seijo · Canadian Journal of Chemistry · 1992 · 220 citations

Natural Sciences, Chemistry, Physics +13