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PhD Theses related to ADF
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Theses PhD Theses related to ADF Topic Author Year Download Hypervalence and Aromaticity Simon Pierrefixe 2008 pdf Computational Modeling of Oxidation Catalysis Manuel Louwerse 2008 pdf Frozen-Density Embedding Christoph Jacob 2007 pdf Theoretical Studies on Catalytic Bond Activation Theodoor de Jong 2007 pdf Computational Studies in Actinide Chemistry Ivan Infante 2006 pdf Time-dependent current DFT for molecules Meta van Faassen 2005 pdf Optical Properties of Nanostructures Lasse Jensen 2004 pdf Improved XC functionals Myrta Grüning 2003 pdf DFT applied to copper proteins Marcel Swart 2002 pdf DNA, parallelization and linearization of ADF Célia Fonseca Guerra 2000 pdf Correlation in DFT (theory) Pieter Schipper 1999 MSWord Time-Dependent DFT Stan van Gisbergen 1998 pdf QM/MM Tom K. Woo 1998 MSWord NMR/ESR Georg Schreckenbach 1996 MSWord ZORA Erik van Lenthe 1996 pdf Intrinsic Reaction Coordinate Liqun Deng 1996 RTF Second Energy Derivatives Heiko Jacobsen 1995 RTF Coupled Perturbed Kohn-Sham Attila Bérces 1995 RTF Kohn-Sham potentials in DFT Robert van Leeuwen 1994 pdf Nonlocal Energy Gradients and Vibrational Spectra Fan Liangyou 1992 RTF Relativistic Effects in Atoms and Molecules Egbert van Wezenbeek 1992 pdf Energy Gradients Louis Versluis 1990 RTF PhD Theses related to BAND Topic Author Year Download Time-dependent current-density-functional theory for metals Pina Romaniello 2006 pdf Current-density functionals in extended systems Arjan Berger 2006 pdf Time-dependent density functional theory for periodic systems Freddie Kootstra 2001 pdf Solids and surfaces Pier Philipsen 2001 Postscript Potential Energy Surfaces and Dynamics for Hydrogen on Pd(111) Roar Olsen 1998 PostScript Band Bert te Velde 1990 MSWord,RTF,pdf http://www.scm.com/Doc/theses.html |
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