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Katarzyna Pernal
Katarzyna Pernal
Professor of Physics, Lodz University of Technology, Poland
Verified email at p.lodz.pl - Homepage
Title
Cited by
Cited by
Year
An improved density matrix functional by physically motivated repulsive corrections
O Gritsenko, K Pernal, EJ Baerends
The Journal of chemical physics 122 (20), 2005
2232005
Dispersionless density functional theory
K Pernal, R Podeszwa, K Patkowski, K Szalewicz
Physical review letters 103 (26), 263201, 2009
2022009
Electron localizability indicator for correlated wavefunctions. I. Parallel-spin pairs
M Kohout, K Pernal, FR Wagner, Y Grin
Theoretical Chemistry Accounts 112, 453-459, 2004
1932004
The ground state of harmonium
J Cioslowski, K Pernal
The Journal of Chemical Physics 113 (19), 8434-8443, 2000
1412000
DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science
AM Teale, T Helgaker, A Savin, C Adamo, B Aradi, AV Arbuznikov, ...
Physical chemistry chemical physics 24 (47), 28700-28781, 2022
1232022
A density matrix functional with occupation number driven treatment of dynamical and nondynamical correlation
DR Rohr, K Pernal, OV Gritsenko, EJ Baerends
The Journal of chemical physics 129 (16), 2008
1122008
Time-dependent density-matrix-functional theory
K Pernal, O Gritsenko, EJ Baerends
Physical Review A 75 (1), 012506, 2007
1072007
Extension of the Hartree− Fock plus dispersion method by first-order correlation effects
R Podeszwa, K Pernal, K Patkowski, K Szalewicz
The Journal of Physical Chemistry Letters 1 (2), 550-555, 2010
1032010
Reduced density matrix functional theory (RDMFT) and linear response time-dependent RDMFT (TD-RDMFT)
K Pernal, KJH Giesbertz
Density-Functional Methods for Excited States, 125-183, 2016
1022016
Effective potential for natural spin orbitals
K Pernal
Physical review letters 94 (23), 233002, 2005
992005
Constraints upon natural spin orbital functionals imposed by properties of a homogeneous electron gas
J Cioslowski, K Pernal
The Journal of chemical physics 111 (8), 3396-3400, 1999
891999
Intergeminal correction to the antisymmetrized product of strongly orthogonal geminals derived from the extended random phase approximation
K Pernal
Journal of Chemical Theory and Computation 10 (10), 4332-4341, 2014
772014
Excitation energies from extended random phase approximation employed with approximate one-and two-electron reduced density matrices
K Chatterjee, K Pernal
The Journal of Chemical Physics 137 (20), 2012
722012
Ionization potentials from the extended Koopmans’ theorem applied to density matrix functional theory
K Pernal, J Cioslowski
Chemical physics letters 412 (1-3), 71-75, 2005
722005
Excitation energies with time-dependent density matrix functional theory: Singlet two-electron systems
KJH Giesbertz, K Pernal, OV Gritsenko, EJ Baerends
The Journal of chemical physics 130 (11), 2009
702009
Electron localizability indicator for correlated wavefunctions. II Antiparallel-spin pairs
M Kohout, K Pernal, FR Wagner, Y Grin
Theoretical Chemistry Accounts 113, 287-293, 2005
692005
The equivalence of the Piris Natural Orbital Functional 5 (PNOF5) and the antisymmetrized product of strongly orthogonal geminal theory
K Pernal
Computational and Theoretical Chemistry 1003, 127-129, 2013
682013
Electron correlation from the adiabatic connection for multireference wave functions
K Pernal
Physical review letters 120 (1), 013001, 2018
612018
Orbital‐free effective embedding potential: Density‐matrix functional theory case
K Pernal, TA Wesolowski
International Journal of Quantum Chemistry 109 (11), 2520-2525, 2009
612009
Combining density-functional theory and density-matrix-functional theory
DR Rohr, J Toulouse, K Pernal
Physical Review A 82 (5), 052502, 2010
552010
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