About
Dr. Jacek Dziedzic is a Senior Research Fellow in the group of Chris-Kriton Skylaris. He works on linear-scaling density functional theory. He is one of the authors and developers of the ONETEP computer code.
Research
Research groups
Member of:
Current research
Jacek Dziedzic works on linear-scaling density functional theory (O(N)-DFT), and in particular, on the ONETEP approach in the group of Chris-Kriton Skylaris. He is one of the authors and developers of the ONETEP computer code. His main areas of interest are implicit solvation methods, Hartree-Fock exchange and QM/MM methods using polarizable force-fields.
Publications
30 publications
Page 1 of 3
Arihant Bhandari, Jacek Dziedzic, John R. Owen, Denis Kramer & Chris Kriton Skylaris,
2024, Journal of Materials Chemistry A, 12(43), 30073-30081
DOI: 10.1039/d4ta04834b
Type: article
Michael P. Mercer, Arihant Bhandari, Chao Peng, Jacek Dziedzic, Chris K. Skylaris & Denis Kramer,
2024, Physical Chemistry Chemical Physics, 26(22), 16175-16183
DOI: 10.1039/D4CP01079E
Type: article
Szymon Winczewski, Jacek Dziedzic, Tadeusz Miruszewski, Jarosław Rybicki & Maria Gazda,
2022, Journal of Physical Chemistry C, 126(43), 18439-18465
Type: article
Arihant Bhandari, Chao Peng, Jacek Dziedzic, John R. Owen, Denis Kramer & Chris Kriton Skylaris,
2022, Journal of Materials Chemistry A, 10(21), 11426-11436
DOI: 10.1039/d2ta02420a
Type: article
Jacek Dziedzic, James C Womack, Rozh Ali & Chris-Kriton Skylaris,
2021, The Journal of Chemical Physics, 155(22)
DOI: 10.1063/5.0067781
Type: article
Chao Peng, Arihant Bhandari, Jacek Dziedzic, John R. Owen, Chris-Kriton Skylaris & Denis Kramer,
2021, Journal of Materials Chemistry A, 9(31), 16798-16804
DOI: 10.1039/D1TA03447B
Type: article
Arihant Bhandari, Chao Peng, Jacek Dziedzic, Lucian Anton, John R. Owen, Denis Kramer & Chris Kriton Skylaris,
2021, Journal of Chemical Physics, 155(2)
DOI: 10.1063/5.0056514
Type: article
Arihant Bhandari, Lucian Anton, Jacek Dziedzic, Chao Peng, Denis Kramer & Chris Kriton Skylaris,
2020, Journal of Chemical Physics, 153(12)
DOI: 10.1063/5.0021210
Type: article
The role of electrostatics in enzymes: do biomolecular force fields reflect protein electric fields?
Richard Bradshaw, Jacek Dziedzic, Chris-Kriton Skylaris & Jonathan W. Essex,
2020, Journal of Chemical Information and Modeling, 60(6), 3131-3144
Type: article
Joseph C.A. Prentice, Jolyon Aarons, James C. Womack, Alice E.A. Allen, Lampros Andrinopoulos, Lucian Anton, Robert A. Bell, Arihant Bhandari, Gabriel A. Bramley, Robert J. Charlton, Rebecca J. Clements, Daniel J. Cole, Gabriel Constantinescu, Fabiano Corsetti, Simon M.M. Dubois, Kevin K.B. Duff, José María Escartín, Andrea Greco, Quintin Hill, Louis P. Lee, Edward Linscott, David D. O'Regan, Maximillian J.S. Phipps, Laura E. Ratcliff, Álvaro Ruiz Serrano, Edward W. Tait, Gilberto Teobaldi, Valerio Vitale, Nelson Yeung, Tim J. Zuehlsdorff, Jacek Dziedzic, Peter D. Haynes, Nicholas D.M. Hine, Arash A. Mostofi, Mike C. Payne & Chris Kriton Skylaris,
2020, The Journal of Chemical Physics, 152(17)
DOI: 10.1063/5.0004445
Type: article