Krzysztof Wolinski

Publication Activity (10 Years)

Years Active: 1997-2022
Publications (10 Years): 2

Top Topics

Gradient Vector Flow

External Forces

Top Venues

J. Comput. Chem.

J. Chem. Inf. Model.

Publications

Agnieszka Brzyska, Krzysztof Wolinski
Search for transition states with external forces. J. Comput. Chem. 43 (9) (2022)
Agnieszka Brzyska, Krzysztof Wolinski
Isomerization and Decomposition of 2-Methylfuran with External Forces. J. Chem. Inf. Model. 59 (8) (2019)
Jon Baker, Krzysztof Wolinski
Isomerization of stilbene using enforced geometry optimization. J. Comput. Chem. 32 (1) (2011)
Jon Baker, Krzysztof Wolinski
An efficient parallel algorithm for the calculation of unrestricted canonical MP2 energies. J. Comput. Chem. 32 (15) (2011)
Jon Baker, Krzysztof Wolinski, Massimo Malagoli, Don Kinghorn, Pawel Wolinski, Gábor Magyarfalvi, Svein Saebo, Tomasz Janowski, Peter Pulay
Quantum chemistry in parallel with PQS. J. Comput. Chem. 30 (2) (2009)
Jon Baker, Krzysztof Wolinski, Peter Pulay
Parallel DFT gradients using the Fourier Transform Coulomb method. J. Comput. Chem. 28 (16) (2007)
Alexander V. Mitin, Jon Baker, Krzysztof Wolinski, Peter Pulay
Parallel stored-integral and semidirect Hartree-Fock and DFT methods with data compression. J. Comput. Chem. 24 (2) (2003)
Krzysztof Wolinski, Robert Haacke, James F. Hinton, Peter Pulay
Methods for parallel computation of SCF NMR chemical shifts by GIAO method: Efficient integral calculation, multi-Fock algorithm, and pseudodiagonalization. J. Comput. Chem. 18 (6) (1997)