Showing results (1-10 of 131) with videos related to
Sort By:
Pageof 14
The Journal of Chemical Physics|April 28, 2007
Frequency-dependent nonlinear optical properties with explicitly correlated coupled-cluster response theory using the CCSD(R12) modelChristian Neiss, Christof HättigThe Journal of Chemical Physics|September 1, 2006
Extensions of r12 corrections to CC2-R12 for excited statesChristian Neiss, Christof Hättig, Wim KlopperPhysical Chemistry Chemical Physics : PCCP|April 14, 2007
Quintuple-zeta quality coupled-cluster correlation energies with triple-zeta basis setsDavid P Tew, Wim Klopper, Christian Neiss, et al.The Journal of Chemical Physics|April 2, 2009
Structures and harmonic vibrational frequencies for excited states of diatomic molecules with CCSD(R12) and CCSD(F12) modelsJun Yang, Christof HättigThe Journal of Chemical Physics|December 14, 2011
Local pair natural orbitals for excited statesBenjamin Helmich, Christof HättigThe Journal of Chemical Physics|December 25, 2016
Perturbative triples correction for local pair natural orbital based explicitly correlated CCSD(F12*) using Laplace transformation techniquesGunnar Schmitz, Christof HättigJournal of Chemical Theory and Computation|March 7, 2024
Role of Singles Amplitudes in ADC(2) and CC2 for Low-Lying Electronically Excited StatesNiklas Sülzner, Christof HättigPhysical Chemistry Chemical Physics : PCCP|April 4, 2020
Correction: A quantum chemical study of hydrogen adsorption on carbon-supported palladium clustersLisa Warczinski, Christof HättigPhysical Chemistry Chemical Physics : PCCP|September 21, 2019
A quantum chemical study of hydrogen adsorption on carbon-supported palladium clustersLisa Warczinski, Christof HättigJournal of Chemical Theory and Computation|May 18, 2017
Accuracy of Explicitly Correlated Local PNO-CCSD(T)Gunnar Schmitz, Christof HättigPageof 14