Katarzyna Pernal - Dissemin

Papers authored by Katarzyna Pernal

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2004 Jerzy Cioslowski, Katarzyna Pernal

Size versus volume extensivity of a new class of density matrix functionals

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Katarzyna Pernal

, Jerzy Cioslowski

Phase dilemma in density matrix functional theory

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2003 P. Ziesche, K. Pernal

, F. Tasnádi

New sum rules relating the 1-body momentum distribution of the homogeneous electron gas to the Kimball–Overhauser 2-body wave functions (geminals) of its pair density

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M. Taut, K. Pernal

, J. Cioslowski, V. Staemmler

Three electrons in a harmonic oscillator potential: Pairs versus single particles

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Jerzy Cioslowski, Katarzyna Pernal

, Marcin Buchowiecki

Approximate one-matrix functionals for the electron–electron repulsion energy from geminal theories

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Jerzy Cioslowski, Niny Rao, Katarzyna Pernal

, David Moncrieff

Endohedral motions inside capped single-walled carbon nanotubes

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2002 Jerzy Cioslowski, Katarzyna Pernal

, Paul Ziesche

Systematic construction of approximate one-matrix functionals for the electron-electron repulsion energy

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Jerzy Cioslowski, Katarzyna Pernal

Density matrix functional theory of weak intermolecular interactions

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Jerzy Cioslowski, Katarzyna Pernal

Variational density matrix functional theory calculations with the lowest-order Yasuda functional

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2001 W. M. Bartczak, K. Pernal

Potential traps for an excess electron in liquid water: the trap lifetime distributions

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Witold M. Bartczak, Jerzy Kroh, Michal Zapalowski, Katarzyna Pernal

Computer simulation of water and concentrated ionic solutions. Potential fluctuations and electron localization

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Jerzy Cioslowski, Niny Rao, Agnieszka Szarecka, Katarzyna Pernal

Theoretical thermochemistry of the C₆₀F₁₈, C₆₀F₃₆, and C₆₀F₄₈fluorofullerenes

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Jerzy Cioslowski, Paul Ziesche, Katarzyna Pernal

On the exactness of simple natural spin-orbital functionals for a high-density homogeneous electron gas

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Katarzyna Pernal

, Jerzy Cioslowski

On the validity of the extended Koopmans’ theorem

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Jerzy Cioslowski, Paul Ziesche, Katarzyna Pernal

Description of a high-density homogeneous electron gas with the Yasuda density matrix functional

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Jerzy Cioslowski, Katarzyna Pernal

Response properties and stability conditions in density matrix functional theory

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2000 W. M. Bartczak, K. Pernal

Potential traps for an excess electron in liquid water. Geometry, energy distributions and lifetime

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Jerzy Cioslowski, Katarzyna Pernal

Description of a homogeneous electron gas with simple functionals of the one-particle density matrix

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Jerzy Cioslowski, Katarzyna Pernal

The ground state of harmonium

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1999 Jerzy Cioslowski, Katarzyna Pernal

Constraints upon natural spin orbital functionals imposed by properties of a homogeneous electron gas

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Papers authored by Katarzyna Pernal