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Behavior Research Methods|April 17, 2008
Comparison of automated procedures for ARMA model identificationTetiana Stadnytska, Simone Braun, Joachim WernerPhysical Chemistry Chemical Physics : PCCP|November 20, 2012
Pyrazine excited states revisited using the extended multi-state complete active space second-order perturbation methodToru Shiozaki, Clemens Woywod, Hans-Joachim WernerScience (New York, N.Y.)|December 25, 2004
First-principles theory for the H + CH4 --> H2 + CH3 reactionTao Wu, Hans-Joachim Werner, Uwe ManthePhysical Chemistry Chemical Physics : PCCP|October 22, 2005
Towards accurate ab initio calculations on the vibrational modes of the alkaline earth metal hydridesTomica Hrenar, Hans-Joachim Werner, Guntram RauhutThe Journal of Chemical Physics|December 10, 2017
Analytical energy gradients for explicitly correlated wave functions. I. Explicitly correlated second-order Møller-Plesset perturbation theoryWerner Győrffy, Gerald Knizia, Hans-Joachim WernerThe Journal of Chemical Physics|October 27, 2016
Local complete active space second-order perturbation theory using pair natural orbitals (PNO-CASPT2)Filipe Menezes, Daniel Kats, Hans-Joachim WernerPhysical Chemistry Chemical Physics : PCCP|October 9, 2009
A short-range gradient-corrected density functional in long-range coupled-cluster calculations for rare gas dimersErich Goll, Hans-Joachim Werner, Hermann StollThe Journal of Chemical Physics|January 26, 2011
Explicitly correlated multireference configuration interaction: MRCI-F12Toru Shiozaki, Gerald Knizia, Hans-Joachim WernerThe Journal of Chemical Physics|April 14, 2007
Accurate calculation of anharmonic vibrational frequencies of medium sized molecules using local coupled cluster methodsTomica Hrenar, Hans-Joachim Werner, Guntram RauhutThe Journal of Chemical Physics|May 6, 2006
Accurate potential energy surface and quantum reaction rate calculations for the H+CH4-->H2+CH3 reactionTao Wu, Hans-Joachim Werner, Uwe ManthePageof 11