Computational Mechanics

Results: 1004



#Item
351Density functional theory / Computational chemistry / Computational physics / Quantum chemistry / Theoretical chemistry / Hybrid functional / Hartree–Fock method / Time-dependent density functional theory / Crystal / Chemistry / Physics / Quantum mechanics

Copyright © 2006 American Scientific Publishers All rights reserved Printed in the United States of America Journal of Computational and Theoretical Nanoscience

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Source URL: yangtze.hku.hk

Language: English - Date: 2010-12-19 08:35:06
352Game mechanics / Video game design / Software / Cover system / Gameplay / Platform game / Project Torque / Game design / Gaming / Windows games

Mechanic Miner: Reflection-Driven Game Mechanic Discovery and Level Design Michael Cook, Simon Colton, Azalea Raad, and Jeremy Gow Computational Creativity Group Imperial College, London

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Source URL: www.gamesbyangelina.org

Language: English - Date: 2013-01-29 09:04:17
353Statistical mechanics / Computational chemistry / Lagrangian mechanics / Free energy perturbation / Hagen Kleinert / Path integral formulation / Action / Hydrogen atom / Molecular dynamics / Physics / Quantum mechanics / Quantum field theory

CHAPTER 5 Kinetic Isotope Effects from Hybrid Classical and Quantum Path Integral Computations JIALI GAO, KIN-YIU WONG, DAN T. MAJOR,

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Source URL: www.dtc.umn.edu

Language: English - Date: 2012-08-16 12:29:06
354Computational physics / Lattice gas automaton / Quantum mechanics / Statistical mechanics / Cellular automaton / Gas / Quantum field theory / Boltzmann equation / Quantum cellular automata / Physics / Cellular automata / Computational fluid dynamics

10 Cellular Automata and Lattice Gases We started our discussion of partial differential equations by considering how they arise as continuum approximations to discrete systems (such as cars on a highway, or masses conn

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Source URL: fab.cba.mit.edu

Language: English - Date: 2014-04-01 00:13:21
355Brian Spalding / Computational fluid dynamics / Scientific modelling / Combustion / Heat transfer / Simulation / Science / Fluid mechanics / Fluid dynamics / Chemical engineering

Practical CFD for Design Engineers From the pioneers of CFD. What is PHOENICS?

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Source URL: www.cham.co.uk

Language: English - Date: 2006-08-15 07:54:58
356Force field / Quantum mechanics / Molecule / Physics / Petascale / Chemical equilibrium / Computational chemistry / Arieh Warshel / Chemistry / Science / Molecular modelling

I NDUS TRY DO CTORAL T RAI NI NG CE NTRE IN MATHEMATICS & STATISTICS

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Source URL: www.atn.edu.au

Language: English - Date: 2015-03-22 22:56:46
357Thermodynamics / Physical quantities / Computational chemistry / Statistical mechanics / Condensed matter physics / Molecular dynamics / Gas / Heat capacity / Thermodynamic equilibrium / Chemistry / Physics / Science

Interactive molecular dynamics Daniel V. Schroedera) Physics Department, Weber State University, Ogden, Utah[removed]Received 6 August 2014; accepted 27 October[removed]Physics students now have access to interactive m

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Source URL: physics.weber.edu

Language: English - Date: 2015-02-28 19:02:35
358Science / Computational chemistry / Theoretical chemistry / Quantum mechanics / Polarization / Circular dichroism / Hartree–Fock method / Hamiltonian / Chemistry / Physics / Quantum chemistry

Chemical Physics[removed]–189 www.elsevier.com/locate/chemphys Localized-density-matrix calculation of circular dichroism spectrum of optically active molecule WanZhen Liang 1, Satoshi Yokojima 2, GuanHua Chen *

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Source URL: yangtze.hku.hk

Language: English - Date: 2010-12-19 08:35:05
359Fluid dynamics / Computational science / 3D computer graphics / Smoothed-particle hydrodynamics / Fluid simulation / Computer graphics / Volume of fluid method / Rendering / Eurographics / Computational fluid dynamics / Dynamics / Fluid mechanics

Eurographics/ ACM SIGGRAPH Symposium on Computer Animation (2010), pp. 1–9 M. Otaduy and Z. Popovic (Editors) Reconstructing Surfaces of Particle-Based Fluids Using Anisotropic Kernels Submission ID 1044

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Source URL: www.cs.nyu.edu

Language: English - Date: 2012-02-08 01:15:13
360Computational chemistry / Statistical mechanics / Chemical kinetics / Kinetic isotope effect / Physical organic chemistry / Free energy perturbation / Molecular dynamics / Quantum mechanics / Path integral formulation / Physics / Chemistry / Science

Combined QM/MM and Path Integral Simulations of Kinetic Isotope Effects in the Proton Transfer Reaction Between Nitroethane and Acetate Ion in Water JIALI GAO,1,2 KIN-YIU WONG,1 DAN T. MAJOR1,3 1

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Source URL: www.dtc.umn.edu

Language: English - Date: 2012-08-16 12:29:04
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