Kasper Kristensen
Kasper Kristensen
Verified email at chem.au.dk
Cited by
Cited by
The D alton quantum chemistry program system
K Aidas, C Angeli, KL Bak, V Bakken, R Bast, L Boman, O Christiansen, ...
Wiley Interdisciplinary Reviews: Computational Molecular Science 4 (3), 269-284, 2014
Recent advances in wave function-based methods of molecular-property calculations
T Helgaker, S Coriani, P Jørgensen, K Kristensen, J Olsen, K Ruud
Chemical reviews 112 (1), 543-631, 2012
A density matrix-based quasienergy formulation of the Kohn–Sham density functional response theory using perturbation-and time-dependent basis sets
AJ Thorvaldsen, K Ruud, K Kristensen, P Jørgensen, S Coriani
The Journal of chemical physics 129 (21), 214108, 2008
A locality analysis of the divide–expand–consolidate coupled cluster amplitude equations
K Kristensen, M Ziółkowski, B Jansik, T Kjærgaard, P Jørgensen
Journal of Chemical Theory and Computation 7 (6), 1677-1694, 2011
Local orbitals by minimizing powers of the orbital variance
B Jansík, S Høst, K Kristensen, P Jørgensen
The Journal of chemical physics 134 (19), 194104, 2011
The divide-expand-consolidate family of coupled cluster methods: Numerical illustrations using second order Møller-Plesset perturbation theory
IM Høyvik, K Kristensen, B Jansik, P Jørgensen
The Journal of Chemical Physics 136 (1), 014105, 2012
Linear-scaling coupled cluster with perturbative triple excitations: The divide–expand–consolidate CCSD (T) model
JJ Eriksen, P Baudin, P Ettenhuber, K Kristensen, T Kjærgaard, ...
Journal of chemical theory and computation 11 (7), 2984-2993, 2015
Quasienergy formulation of damped response theory
K Kristensen, J Kauczor, T Kjærgaard, P Jørgensen
The Journal of chemical physics 131 (4), 044112, 2009
MP2 energy and density for large molecular systems with internal error control using the Divide-Expand-Consolidate scheme
K Kristensen, IM Høyvik, B Jansik, P Jørgensen, T Kjærgaard, S Reine, ...
Physical Chemistry Chemical Physics 14 (45), 15706-15714, 2012
Molecular gradient for second-order Møller-Plesset perturbation theory using the divide-expand-consolidate (DEC) scheme
K Kristensen, P Jørgensen, B Jansík, T Kjærgaard, S Reine
The Journal of chemical physics 137 (11), 114102, 2012
Efficient elimination of response parameters in molecular property calculations for variational and nonvariational energies
K Kristensen, P Jørgensen, AJ Thorvaldsen, T Helgaker
The Journal of chemical physics 129 (21), 214103, 2008
Electrostatic potential of insulin: Exploring the limitations of density functional theory and force field methods
S Jakobsen, K Kristensen, F Jensen
Journal of chemical theory and computation 9 (9), 3978-3985, 2013
The divide–expand–consolidate MP2 scheme goes massively parallel
K Kristensen, T Kjærgaard, IM Høyvik, P Ettenhuber, P Jørgensen, ...
Molecular Physics 111 (9-11), 1196-1210, 2013
Damped response theory description of two-photon absorption
K Kristensen, J Kauczor, AJ Thorvaldsen, P Jørgensen, T Kjærgaard, ...
The Journal of chemical physics 134 (21), 214104, 2011
Basis set convergence of the binding energies of strongly hydrogen-bonded atmospheric clusters
J Elm, K Kristensen
Physical Chemistry Chemical Physics 19 (2), 1122-1133, 2017
Accuracy of protein embedding potentials: An analysis in terms of electrostatic potentials
JMH Olsen, NH List, K Kristensen, J Kongsted
Journal of chemical theory and computation 11 (4), 1832-1842, 2015
Efficient linear-scaling second-order Møller-Plesset perturbation theory: The divide–expand–consolidate RI-MP2 model
P Baudin, P Ettenhuber, S Reine, K Kristensen, T Kjærgaard
The Journal of chemical physics 144 (5), 054102, 2016
LoFEx - A local framework for calculating excitation energies: Illustrations using RI-CC2 linear response theory
P Baudin, K Kristensen
The Journal of Chemical Physics 144 (22), 224106, 2016
A Lagrangian framework for deriving triples and quadruples corrections to the CCSD energy
JJ Eriksen, K Kristensen, T Kjærgaard, P Jørgensen, J Gauss
The Journal of chemical physics 140 (6), 064108, 2014
The divide–expand–consolidate coupled cluster scheme
T Kjærgaard, P Baudin, D Bykov, K Kristensen, P Jørgensen
Wiley Interdisciplinary Reviews: Computational Molecular Science 7 (6), e1319, 2017
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