Publications (41)
Spooky correlations and unusual van der Waals forces between gapless and near-gapless molecules
John F. Dobson, Andreas Savin, Janos G. Angyan +1
Excitation energies along a range-separated adiabatic connection
Elisa Rebolini, Julien Toulouse, Andrew M. Teale +2
Short-range exchange and correlation energy density functionals: beyond the local density approximation
Julien Toulouse, Francois Colonna, Andreas Savin
Curing basis-set convergence of wave-function theory using density-functional theory: a systematically improvable approach
Emmanuel Giner, Barthélémy Pradines, Anthony Ferté +3
Excited states from range-separated density-functional perturbation theory
Elisa Rebolini, Julien Toulouse, Andrew M. Teale +2
Model hamiltonians in density functional theory
Paola Gori-Giorgi, Julien Toulouse, Andreas Savin
Probabilistic performance estimators for computational chemistry methods: the empirical cumulative distribution function of absolute errors
Pascal Pernot, Andreas Savin
Kohn-Sham calculations combined with an average pair-density functional theory
Paola Gori-Giorgi, Andreas Savin
Study of the discontinuity of the exchange-correlation potential in an exactly soluble case
Paola Gori-Giorgi, Andreas Savin
Strictly correlated electrons in density functional theory: A general formulation with applications to spherical densities
Michael Seidl, Paola Gori-Giorgi, Andreas Savin
Double-hybrid density-functional theory made rigorous
Kamal Sharkas, Julien Toulouse, Andreas Savin
Exchange-correlation potentials and local energies per particle along non-linear adiabatic connections
Julien Toulouse, Francois Colonna, Andreas Savin
Calculating excitation energies by extrapolation along adiabatic connections
Elisa Rebolini, Julien Toulouse, Andrew M. Teale +2
A short-range correlation energy density functional with multi-determinantal reference
Julien Toulouse, Paola Gori-Giorgi, Andreas Savin
Van der Waals forces in density functional theory: perturbational long-range electron interaction corrections
Janos G. Angyan, Iann C. Gerber, Andreas Savin +1
Exchange-correlation functionals via local interpolation along the adiabatic connection
Stefan Vuckovic, Tom Irons, Andreas Savin +2
Range-separated density-functional theory applied to the beryllium dimer and trimer
Peter Reinhardt, Julien Toulouse, Andreas Savin
Excitation energies from G{ö}rling-Levy perturbation theory along the range-separated adiabatic connection
Elisa Rebolini, Andrew M. Teale, Trygve Helgaker +2
Range-separated density-functional theory with random phase approximation applied to noncovalent intermolecular interactions
Wuming Zhu, Julien Toulouse, Andreas Savin +1
Electronic excitations from a linear-response range-separated hybrid scheme
Elisa Rebolini, Andreas Savin, Julien Toulouse
Degeneracy and size consistency in electronic density functional theory
Paola Gori-Giorgi, Andreas Savin
Long-range/short-range separation of the electron-electron interaction in density functional theory
Julien Toulouse, Francois Colonna, Andreas Savin
Adiabatic-connection fluctuation-dissipation density-functional theory based on range separation
Julien Toulouse, Iann C. Gerber, Georg Jansen +2
Intracule densities in the strong-interaction limit of density functional theory
Paola Gori-Giorgi, Michael Seidl, Andreas Savin
Properties of short-range and long-range correlation energy density functionals from electron-electron coalescence
Paola Gori-Giorgi, Andreas Savin
Short-range exchange-correlation energy of a uniform electron gas with modified electron-electron interaction
Julien Toulouse, Andreas Savin, Heinz-Jürgen Flad
Range-separated density-functional theory with random phase approximation: detailed formalism and illustrative applications
Julien Toulouse, Wuming Zhu, Janos G. Angyan +1
System-adapted correlation energy density functionals from effective pair interactions
Paola Gori-Giorgi, Andreas Savin
The high-density limit of two-electron systems: Results from the extended Overhauser approach
Paola Gori-Giorgi, Andreas Savin
Local density approximation for long-range or for short-range energy functionals?
Julien Toulouse, Andreas Savin
Full Configuration Interaction wave function as a formal solution to the Optimized Effective Potential and Kohn-Sham models in finite basis sets
Daniel R. Rohr, Andreas Savin
Range separation combined with the Overhauser model: Application to the H$_2$ molecule along the dissociation curve
Paola Gori-Giorgi, Andreas Savin
Smooth models for the Coulomb potential
Cristina E. González-Espinoza, Paul. W Ayers, Jacek Karwowski +1
Symmetry Breaking of Relativistic Multiconfiguration Methods in the Nonrelativistic Limit
Maria J. Esteban, Mathieu Lewin, Andreas Savin
Electronic excitation energies of molecular systems from the Bethe-Salpeter equation: Example of the H2 molecule
Elisa Rebolini, Julien Toulouse, Andreas Savin
A multiconfigurational hybrid density-functional theory
Kamal Sharkas, Andreas Savin, Hans Jørgen Aa. Jensen +1
Constrained-Pairing Mean-Field Theory. IV. Inclusion of corresponding pair constraints and connection to unrestricted Hartree-Fock theory
Takashi Tsuchimochi, Thomas M. Henderson, Gustavo E. Scuseria +1
Maximum probability domains for the analysis of the microscopic structure of liquids
Federica Agostini, Giovanni Ciccotti, Andreas Savin +1
Scaling relations, virial theorem and energy densities for long-range and short-range density functionals
Julien Toulouse, Paola Gori-Giorgi, Andreas Savin
Closed-shell ring coupled cluster doubles theory with range separation applied on weak intermolecular interactions
Julien Toulouse, Wuming Zhu, Andreas Savin +2
Simple model for the spherically- and system-averaged pair density: Results for two-electron atoms
Paola Gori-Giorgi, Andreas Savin