| 2009 |
|---|
| 4 | EE | Jon Baker,
Krzysztof Wolinski,
Massimo Malagoli,
Don Kinghorn,
Pawel Wolinski,
Gábor Magyarfalvi,
Svein Saebo,
Tomasz Janowski,
Peter Pulay:
Quantum chemistry in parallel with PQS.
Journal of Computational Chemistry 30(2): 317-335 (2009) |
| 2007 |
|---|
| 3 | EE | Jon Baker,
Krzysztof Wolinski,
Peter Pulay:
Parallel DFT gradients using the Fourier Transform Coulomb method.
Journal of Computational Chemistry 28(16): 2581-2588 (2007) |
| 2003 |
|---|
| 2 | EE | Alexander V. Mitin,
Jon Baker,
Krzysztof Wolinski,
Peter Pulay:
Parallel stored-integral and semidirect Hartree-Fock and DFT methods with data compression.
Journal of Computational Chemistry 24(2): 154-160 (2003) |
| 1997 |
|---|
| 1 | EE | 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.
Journal of Computational Chemistry 18(6): 816-825 (1997) |
