Charge-transfer separability and size-extensivity in the equation-of-motion coupled cluster method: EOM-CCx

Calculation of properties with the coupled-cluster method

(2010) Hendrik J. Monkhorst   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

Electronic Transition Energies: A Study of the Performance of a Large Range of Single Reference Density Functional and Wave Function Methods on Valence and Rydberg States Compared to Experiment

(2010) Marco Caricato et al.   Journal of Chemical Theory and Computation

Efficient realization of the Fock-space coupled-cluster method with connected triple excitations

(2009) Monika Musial   CHEMICAL PHYSICS LETTERS

Spin-free intermediate Hamiltonian Fock space coupled-cluster theory with full inclusion of triple excitations for restricted Hartree Fock based triplet states

(2009) Monika Musial et al.   JOURNAL OF CHEMICAL PHYSICS

Excited and ionized states of the ozone molecule with full triples coupled cluster methods

(2009) Monika Musiał et al.   JOURNAL OF CHEMICAL PHYSICS

Equation-of-Motion Coupled-Cluster Methods for Open-Shell and Electronically Excited Species: The Hitchhiker's Guide to Fock Space

(2008) Anna I. Krylov   Annual Review of Physical Chemistry

Benchmark calculations of the Fock-space coupled cluster single, double, triple excitation method in the intermediate Hamiltonian formulation for electronic excitation energies

(2008) Monika Musial et al.   CHEMICAL PHYSICS LETTERS

Ground state and vertical excitation energies of the diazene isomers with the coupled cluster method

(2008) Katarzyna Szopa et al.   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

Intermediate Hamiltonian Fock-space multireference coupled-cluster method with full triples for calculation of excitation energies

(2008) Monika Musial et al.   JOURNAL OF CHEMICAL PHYSICS

Multireference Fock-space coupled-cluster and equation-of-motion coupled-cluster theories: The detailed interconnections

(2008) Monika Musial et al.   JOURNAL OF CHEMICAL PHYSICS