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Combinatoria Molecular
Category :Combinatorial Chemistry  Language: clicks: 102
Combinatoria Molecular La Combinatoria Molecular es un conjunto de tecnologías dentro de las que se encuentran la Química y la Biología combinatoria, la Proteómica , la Genómica, las Bibliotecas Virtuales y los Métodos de t . . . . .
Chemistry Data Book
Category :Chemistry  Language: clicks: 122
This Data Book contains a selection of information and data which is relevant to the Chemistry Courses at York.
Nanotechnology in Catalysis
Category :Catalysis  Language: clicks: 155
Contents: Section I reviews the new concepts and applications of nanotechnology for catal- ysis. Chapter 1 provides an overview on how nanotechnology impacts catalyst prepa- ration with more control . . . . .
Electrochemistry
Category :Electrochemistry  Language: clicks: 162
Electrochemistry Electrochemistry has been undergoing significant transformations in the last few decades. It is now the province of academics interested only in measuring thermodynamic properties of solutions and of . . . . .
Basic Research Needs: Catalysis for Energy
Category :Catalysis  Language: clicks: 162
Basic Research Needs: Catalysis for Energy Contents:Grand Challenges in Catalysis as a Multidisciplinary Science and Technology; Advanced Catalysts for the Conversion of Heavy Fossil Energy Feedstocks; Advanced Catalysts for the Photo- and E . . . . .
A Statistical Mechanical Approach to Combinatorial Chemistry
Category :Computational Chemistry  Language: clicks: 177
An analogy between combinatorial chemistry and Monte Carlo computer simulation is pursued. Examples of how to design libraries for both materials discovery and protein molecular evolution are given. F . . . . .
Introduction to Electronic Structure Methods
Category :Solid State Chemistry  Language: clicks: 181
Contents: Introduction to computational quantum chemistry; Basic Principles of quantum mechanics; Basis functions in quantum chemistry; An Introduction to Hartree Fock Theory; n Introduction to Config . . . . .
Chimie Inorganique
Category :Inorganic Chemistry   Language: clicks: 182
Contenu: Chapitre I : Principes généraux; Chapitre II : Eléments des blocs s et p; Chapitre III : Eléments du bloc d.
Notes on Quantum Chemistry
Category :Quantum Chemistry  Language: clicks: 183
Notes on Quantum Chemistry Contents: A Brief Review of Elementary Quantum Chemistry; Computational Quantum Chemistry; An Introduction to Electronic Structure Theory; Atomic Term Symbols; Term Symbol Example; Elementary Linear . . . . .
Introduction to Electrochemistry
Category :Physical Chemistry  Language: clicks: 197
The object of this book is to provide an introduction to electrochemistry in its present state of development. An attempt has been made to explain the fundamentals of the subject as it stands today, . . . . .
Quantum Monte Carlo methods for the solution of the Schroedinger
Category :Computational Chemistry  Language: clicks: 202
This is a part of a book chapter soon to appear (2002) in the "Handbook for Numerical Analysis" volume dedicated to "Computational Chemistry" edited by Claude Le Bris. This review deals with some of t . . . . .
High Performance Computing in Chemistry
Category :Computational Chemistry  Language: clicks: 208
High Performance Computing in Chemistry Contents: DFT Functionality in TURBOMOLE; QUI CKSTEP: Make the Atoms Dance; Local Electron Correlation Methods with Density Fitting in MOLPRO; Parallel DFT in TURBOMOLE, Linear Algebra; Continuous Fas . . . . .
An Introduction to Configuration Interaction Theory
Category :Computational Chemistry  Language: clicks: 216
An Introduction to Configuration Interaction Theory 58 pp.
Lecture notes on evaluation of molecular integrals
Category :Computational Chemistry  Language: clicks: 217
Lecture notes on evaluation of molecular integrals.
Introduction to Solid State Chemistry
Category :Solid State Chemistry  Language: clicks: 232
Contents: ATOMIC AND ELECTRONIC STRUCTURE; CHEMICAL BONDING; BONDING IN METALS, SEMICONDUCTORS AND INSULATORS – BAND STRUCTURE; THE NATURE OF CRYSTALLINE SOLIDS; X-RAYS AND X-RAY DIFFRACTION; THE IMP . . . . .


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