Numerische Simulation in der Molekuldynamik : Numerik, Algorithmen, Parallelisierung, Anwendungen
Michael Griebel
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Theory of Charge Transport in Carbon Electronic Materials
Zhigang Shuai
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Quantenmechanik zu Fu 2 : Anwendungen und Erweiterungen
Jochen Pade
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The Augmented Spherical Wave Method : A Comprehensive Treatment
Volker Eyert
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An Introduction to Kinetic Monte Carlo Simulations of Surface Reactions
A.P.J. Jansen
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Thermodynamik : Grundlagen und technische Anwendungen Band 1: Einstoffsysteme
Peter Stephan
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Computational Methods for Physicists : Compendium for Students
Simon Sirca
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State-to-State Dynamical Research in the F+H2 Reaction System
Zefeng Ren
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A New-Generation Density Functional : Towards Chemical Accuracy for Chemistry of Main Group Elements
Igor Ying Zhang
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Growth Mechanisms and Novel Properties of Silicon Nanostructures from Quantum-Mechanical Calculations
Rui-Qin Zhang
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Potential Energy Functions in Conformational Analysis
Kjeld Rasmussen
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Molecular Orbitals and their Energies, Studied by the Semiempirical HAM Method
Einar Lindholm
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Wavefunctions and Mechanisms from Electron Scattering Processes
F.A. Gianturco
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Steric Fit in Quantitative Structure-Activity Relations
A.T. Balaban
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Understanding Luminescence Spectra and Efficiency Using Wp and Related Functions
Charles W. Struck
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Atoms, Chemical Bonds and Bond Dissociation Energies
Sandor Fliszar
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Computer Simulations of Protein Structures and Interactions
Serafin Fraga
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