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Journal of Computational Chemistry|September 29, 2011
An efficient parallel algorithm for the calculation of unrestricted canonical MP2 energiesJon Baker, Krzysztof Wolinski
Journal of Molecular Modeling|September 15, 2010
Kinetically stable high-energy isomers of C14H12 and C12H10N2 derived from cis-stilbene and cis-azobenzeneJon Baker, Krzysztof Wolinski
Journal of Computational Chemistry|July 21, 2010
Isomerization of stilbene using enforced geometry optimizationJon Baker, Krzysztof Wolinski
Journal of Computational Chemistry|May 9, 2007
Parallel DFT gradients using the Fourier Transform Coulomb methodJon Baker, Krzysztof Wolinski, Peter Pulay
The Journal of Chemical Physics|July 23, 2004
An efficient atomic orbital based second-order Møller-Plesset gradient programSvein Saebø, Jon Baker, Krzysztof Wolinski, et al.
Journal of Computational Chemistry|December 24, 2002
Parallel stored-integral and semidirect Hartree-Fock and DFT methods with data compressionAlexander V Mitin, Jon Baker, Krzysztof Wolinski, et al.
Journal of Chemical Theory and Computation|November 2, 2018
Exploring Potential Energy Surface with External ForcesKrzysztof Wolinski
Journal of Computational Chemistry|February 18, 2022
Search for transition states with external forcesAgnieszka Brzyska, Krzysztof Wolinski
Carbohydrate Research|October 3, 2018
Theoretical studies of the pyranose ring under mechanical stressKrzysztof Wolinski, Agnieszka Brzyska
Journal of Magnetic Resonance (San Diego, Calif. : 1997)|January 13, 2009
Theoretical analysis of solvent effects on nitrogen NMR chemical shifts in oxazoles and oxadiazolesAgnieszka Ksiazek, Piotr Borowski, Krzysztof Wolinski
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