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Comment on: "Prediction of Electronic Excited States of Adsorbates on Metal Surfaces from First Principles" Phys. Rev. Lett., vol. 86 (2001) p.5954 by Kluener et al. Wesolowski, Tomasz Adam 2002
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Comparative Infra-Red, Raman, and Natural Bond Orbital Analyses of King's Sultam Hagemann, Hans-Rudolf; Dulak, Marcin; Chapuis, Christian; Wesolowski, Tomasz Adam; Jurczak, Janusz 2004
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Comparative study of benzene··· X (X = O2, N2, CO) complexes using density functional theory : the importance of an accurate exchange-correlation energy density at high reduced density gradients Wesolowski, Tomasz Adam; Parisel, Olivier; Ellinger, Yves; Weber, Jacques 1997
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Constraining the Electron Densities in DFT Method as an Effective Way for Ab Initio Studies of Metal-Catalyzed reactions Hong, Gongyi; Strajbl, Marek; Wesolowski, Tomasz Adam; Warshel, Arieh 2000
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Cooperative effect of hydrogen-bonded chains in the environment of a π → π* chromophore Fradelos, Georgios; Kaminski, Jakub Wojciech; Wesolowski, Tomasz Adam; Leutwyler, Samuel 2009
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Density Functional Study of a Helical Organic Cation Bas, Delphine; Morgantini, Pierre-Yves; Weber, Jacques; Wesolowski, Tomasz Adam 2003
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Density functional theory study of homologous organometallic molecules of the [RhXL2]2 (X=Cl, Br, or I); L=CO, PH3, or PF3) type Seuret, Patrick; Weber, Jacques; Wesolowski, Tomasz Adam 2003
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Density functional theory with an approximate kinetic energy functional applied to study structure and stability of weak van der Waals complexes Wesolowski, Tomasz Adam; Ellinger, Yves; Weber, Jacques 1998
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Density Functional Theory with approximate kinetic energy functionals applied to hydrogen bonds Wesolowski, Tomasz Adam 1997
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Development of Novel Computational Strategies to Match the Challenges of Supramolecular Chemistry, Biochemistry, and Materials Science Wesolowski, Tomasz Adam 2002
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Effect of the f-Orbital Delocalization on the Ligand-Field Splitting Energies in Lanthanide-Containing Elpasolites Zbiri, Mohamed; Daul, Claude; Wesolowski, Tomasz Adam 2006
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Embedding a multideterminantal wave function in an orbital-free environment Wesolowski, Tomasz Adam 2008
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Embedding potentials for excited states of embedded species Wesolowski, Tomasz Adam 2014
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Embedding vs Supermolecular Strategies in Evaluating the Hydrogen-Bonding-Induced Shifts of Excitation Energies Fradelos, Georgios; Lutz, Jesse J.; Wesolowski, Tomasz Adam; Piecuch, Piotr; Włoch, Marta 2011
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Equilibrium Geometries of Noncovalently Bound Intermolecular Complexes Derived from Subsystem Formulation of Density Functional Theory Dulak, Marcin; Kaminski, Jakub Wojciech; Wesolowski, Tomasz Adam 2007
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Estimation of free energy systematic errors of globular proteins surrounded by finite water clusters Wesolowski, Tomasz Adam 1991
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Exact inequality involving the kinetic energy functional Ts[rho] and pairs of electron densities Wesolowski, Tomasz Adam 2003
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Exact non-additive kinetic potentials in realistic chemical systems De Silva, Piotr; Wesolowski, Tomasz Adam 2012
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Extracting Information about Chemical Bonding from Molecular Electron Densities via Single Exponential Decay Detector (SEDD) De Silva, Piotr; Korchowiec, Jacek; Ram J. S., Nirmal; Wesolowski, Tomasz Adam 2013
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First time combination of frozen density embedding theory with the algebraic diagrammatic construction scheme for the polarization propagator of second order Prager, Stefan; Zech, Alexander; Aquilante, Francesco; Dreuw, Andreas; Wesolowski, Tomasz Adam 2016
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