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Full Description
This book will describe recent advances in Quantum Monte Carlo methods including improvements to existing techniques and developments of new techniques. Advances in Quantum Monte Carlo will also include a complete spectrum of applications.
Contents
1. Quantum Monte Carlo Calculations for Helium Dimers and Trimers - Matthew C. Wilson and James B. Anderson ; 2. Energies and Properties of the Hydrogen Molecular Ion - S. A. Alexander and R. L. Coldwell ; 3. Accuracy of a Random Walk Based Approach in the Determination of Equilibrium Bond Lengths and Harmonic Frequencies for Some Doublet First-Row Diatomic Radicals - Shih-I Lu ; 4. Rydberg States with Quantum Monte Carlo - Annika Bande and Arne Luchow ; 5. Linear-Scaling Evaluation of the Local Energy in Quantum Monte Carlo - Brian Austin, Alan Aspuru-Guzik, Romelia Salmon-Ferrer, and William A. Lester, Jr. ; 6. Electronic Quantum Monte Carlo Calculations of Energies and Atomic Forces for Diatomic and Polyatomic Molecules - Myung Won Lee, Massimo Mella, and Andrew M. Rappe ; 7. The Fixed Hypernode Method for the Solution of the Many Body Schroedinger Equation - F. Pederiva, M. H. Kalos, F. Reboredo, D. Bressanini, D. Guclu, L. Colletti, C. J. Umrigar ; 8. Recent Progress in Fermion Monte Carlo - M. H. Kalos and F. Pederiva ; 9. Quantum Effects in Loosely Bound Complexes - Meredith J. T. Jordan, Deborah L. Crittenden and Keiran C. Thompson ; 10. Ab Initio Biomolecular Calculations Using Quantum Monte Carlo Combined with the Fragment Molecular Orbital Method - Ryo Maezona, Hirofumi Watanabe, and Shigenori Tanaka ; 11. Vibrational Excited States by DMC - Anne B. McCoy ; 12. Rotations and Exchange in Doped Helium Clusters: Insight from Imaginary-Time Correlation Functions - Nicholas Blinov and Pierre-Nicholas Roy _ _



