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I Parallel Computing Concepts and Terminology
1 Introduction 3
2 Parallel Computer Architectures 17
3 Communication via Message-Passing 45
4 Multi-Threading 59
5 Parallel Performance Evaluation 71
6 Parallel Program Design 93
II Applications of Parallel Programming in Quantum Chemistry
7 Two-Electron Integral Evaluation 117
8 The Hartree-Fock Method 131
9 Second-Order Moller-Plesset Perturbation Theory 147
10 Local Moller-Plesset Perturbation Theory 167
App. A A Brief Introduction to MPI 181
App. B Pthreads: Explicit Use of Threads 189
App. C OpenMP: Compiler Extensions for Multi-Threading 195
Index 205
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| $99.99 | Digital |
| WonderClub |
Jeff Myers
reviewed Parallel Computing in Quantum Chemistry on June 16, 2010
Parallel Computing in Quantum Chemistry
A rigorous, comprehensive, succinct and even attractively-priced and -bound introduction to machine learning developments since 2000, with an informed focus on bioinformatic applications throughout. This fine job from MIT Press belongs on every researcher's bookshelf.
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