Adsorption of thymine and uracil on 1:1 clay mineral surfaces: comprehensive ab initio study on influence of sodium cation and water
MICHALKOVA, A, ROBINSON, T. L, LESZCZYNSKI, J
Published in PCCP. Physical chemistry chemical physics (Print) (01.01.2011)
Published in PCCP. Physical chemistry chemical physics (Print) (01.01.2011)
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Can the Gibbs Free Energy of Adsorption Be Predicted Efficiently and Accurately: An M05-2X DFT Study
Michalkova, A, Gorb, L, Hill, F, Leszczynski, J
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (24.03.2011)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (24.03.2011)
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Numerical solution of fractional oscillator equation
Blaszczyk, T., Ciesielski, M., Klimek, M., Leszczynski, J.
Published in Applied mathematics and computation (15.11.2011)
Published in Applied mathematics and computation (15.11.2011)
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Electronic band structure, magnetic, transport and thermodynamic properties of In-filled skutterudites InxCo4Sb12
Leszczynski, J, Da Ros, V, Lenoir, B, Dauscher, A, Candolfi, C, Masschelein, P, Hejtmanek, J, Kutorasinski, K, Tobola, J, Smith, R I, Stiewe, C, Müller, E
Published in Journal of physics. D, Applied physics (11.12.2013)
Published in Journal of physics. D, Applied physics (11.12.2013)
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First-principles quantum molecular calculations of structural and mechanical properties of TiN/SiNx heterostructures, and the achievable hardness of the nc-TiN/SiNx nanocomposites
Ivashchenko, V.I., Veprek, S., Argon, A.S., Turchi, P.E.A., Gorb, L., Hill, F., Leszczynski, J.
Published in Thin solid films (02.03.2015)
Published in Thin solid films (02.03.2015)
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Addressing a bottle neck for regulation of nanomaterials: quantitative read-across (Nano-QRA) algorithm for cases when only limited data is available
Gajewicz, A, Jagiello, K, Cronin, M. T. D, Leszczynski, J, Puzyn, T
Published in Environmental science. Nano (01.02.2017)
Published in Environmental science. Nano (01.02.2017)
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Thermoelectric properties and electronic structure of CoSb3 doped with Se and Te
WOJCIECHOWSKI, K. T, TOBOŁA, J, LESZCZYNSKI, J
Published in Journal of alloys and compounds (27.10.2003)
Published in Journal of alloys and compounds (27.10.2003)
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Journal Article
Estimation of Thermoelectric Generator Performance by Finite Element Modeling
Ziolkowski, P., Poinas, P., Leszczynski, J., Karpinski, G., Müller, E.
Published in Journal of electronic materials (01.09.2010)
Published in Journal of electronic materials (01.09.2010)
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Conference Proceeding
Coral: QSPR modeling of rate constants of reactions between organic aromatic pollutants and hydroxyl radical
Toropov, A. A., Toropova, A. P., Rasulev, B. F., Benfenati, E., Gini, G., Leszczynska, D., Leszczynski, J.
Published in Journal of computational chemistry (05.09.2012)
Published in Journal of computational chemistry (05.09.2012)
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Reconstruction of STO-3G Family Basis Set for the Accurate Calculation of Magnetic Properties
Kapusta, K., Voronkov, E., Okovytyy, S., Korobov, V., Leszczynski, J.
Published in Russian Journal of Physical Chemistry A (01.12.2018)
Published in Russian Journal of Physical Chemistry A (01.12.2018)
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Journal Article
Hydrogen-Peroxide-Enhanced Nonthermal Plasma Effluent for Biomedical Applications
Golkowski, M., Golkowski, C., Leszczynski, J., Plimpton, S. R., Maslowski, P., Foltynowicz, A., Jun Ye, McCollister, B.
Published in IEEE transactions on plasma science (01.08.2012)
Published in IEEE transactions on plasma science (01.08.2012)
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Intriguing relations of interaction energy components in stacked nucleic acids
Langner, Karol M, Sokalski, W Andrzej, Leszczynski, J
Published in The Journal of chemical physics (21.09.2007)
Published in The Journal of chemical physics (21.09.2007)
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First-principles molecular dynamics investigation of thermal and mechanical stability of the TiN(001)/AlN and ZrN(001)/AlN heterostructures
Ivashchenko, V.I., Veprek, S., Turchi, P.E.A., Shevchenko, V.I., Leszczynski, J., Gorb, L., Hill, F.
Published in Thin solid films (01.08.2014)
Published in Thin solid films (01.08.2014)
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