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The Journal of Chemical Physics|February 4, 2012
Molecular properties via a subsystem density functional theory formulation: a common framework for electronic embeddingSebastian Höfener, André Severo Pereira Gomes, Lucas VisscherThe Journal of Chemical Physics|November 5, 2005
On the accuracy of one-component pseudopotential spin-orbit calculationsEmmanuel Fromager, Lucas Visscher, Laurent Maron, et al.Journal of the American Chemical Society|December 29, 2007
The chemical bond between Au(I) and the noble gases. Comparative study of NgAuF and NgAu+ (Ng = Ar, Kr, Xe) by density functional and coupled cluster methodsLeonardo Belpassi, Ivan Infante, Francesco Tarantelli, et al.The Journal of Chemical Physics|February 17, 2007
High-accuracy calculation of nuclear quadrupole moments of atomic halogensHana Yakobi, Ephraim Eliav, Lucas Visscher, et al.The Journal of Chemical Physics|March 15, 2013
Bond energy decomposition analysis for subsystem density functional theoryS Maya Beyhan, Andreas W Götz, Lucas VisscherJournal of Computational Chemistry|May 31, 2013
The Becke fuzzy cells integration scheme in the Amsterdam density functional program suiteMirko Franchini, Pierre Herman Theodoor Philipsen, Lucas VisscherThe Journal of Chemical Physics|June 15, 2022
Assessing MP2 frozen natural orbitals in relativistic correlated electronic structure calculationsXiang Yuan, Lucas Visscher, André Severo Pereira GomesThe Journal of Chemical Physics|June 30, 2007
Exact functional derivative of the nonadditive kinetic-energy bifunctional in the long-distance limitChristoph R Jacob, S Maya Beyhan, Lucas VisscherJournal of Chemical Theory and Computation|November 26, 2015
Performance of Kinetic Energy Functionals for Interaction Energies in a Subsystem Formulation of Density Functional TheoryAndreas W Götz, S Maya Beyhan, Lucas VisscherThe Journal of Physical Chemistry. A|June 13, 2012
Charge-transfer excitations in uranyl tetrachloride ([UO2Cl4]2-): how reliable are electronic spectra from relativistic time-dependent density functional theory?Paweł Tecmer, Radovan Bast, Kenneth Ruud, et al.Pageof 16