Molecular mechanics

Results: 397



#Item
291World Association of Theoretical and Computational Chemists / CHARMM / Quantum mechanics / Chemistry / Molecular modelling / Force fields

Michael J. M. Mazack 63 Kolthoff Hall 207 Pleasant St. SE Minneapolis, MN[removed]E-Mail: [removed]

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Source URL: mazack.org

Language: English - Date: 2014-06-09 15:45:15
292Fluid mechanics / Piping / Laboratory equipment / Static mixer / Chemical engineering / Laminar flow / Molecular diffusion / Pressure drop / Viscosity / Aerodynamics / Fluid dynamics / Physics

Laminar Flow in Static Mixers with Helical Elements André Bakker Richard D. LaRoche Elizabeth M. Marshall

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Source URL: www.bakker.org

Language: English - Date: 2000-02-16 10:52:41
293Transport phenomena / Diffusion / Statistical mechanics / Molecular biology / Biophysics / Optical tweezers / Thermophoresis / Molecular diffusion / Brownian motion / Physics / Biology / Chemistry

NANO LETTERS An Optical Conveyor for Molecules Franz M. Weinert and Dieter Braun*

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Source URL: www.biosystems.physik.lmu.de

Language: English - Date: 2012-08-18 20:15:43
294Graphics hardware / Computational physics / Quantum mechanics / Quantum chemistry / GPGPU / Quantum Monte Carlo / Graphics processing unit / FLOPS / Molecular dynamics / Physics / Chemistry / Science

Quantum Monte Carlo on Graphical Processing Units Amos Anderson William A. Goddard III Materials and Process Simulation Center, Division of Chemistry and Chemical Engineering, California Institute of Technology (MC 139-7

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Source URL: www.multires.caltech.edu

Language: English - Date: 2007-08-17 03:18:47
295Polymer physics / Statistical mechanics / Polymers / Polymer / Molecular dynamics / Monte Carlo method / Solid / Simulation / Random coil / Chemistry / Physics / Science

j1 1 Molecular Simulation of Polymer Melts and Blends: Methods, Phase Behavior, Interfaces, and Surfaces Peter Virnau, Kurt Binder, Hendrik Heinz, Torsten Kreer, and Marcus M€

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Source URL: www.wiley-vch.de

Language: English - Date: 2010-06-24 21:03:56
296Molecular physics / Rotation / Spectroscopy / Rigid bodies / Quantum chemistry / Diatomic molecule / Rotational partition function / Energy level / Statistical mechanics / Chemistry / Physics / Science

1 Lecture #15 Lecture 15 Objectives:

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Source URL: puccini.che.pitt.edu

Language: English - Date: 2013-10-18 15:52:16
297Quantum chemistry / Molecular physics / Introductory physics / Atomic physics / Schrödinger equation / Introduction to quantum mechanics / Electron / Energy level / Atomic orbital / Physics / Chemistry / Quantum mechanics

Chapter 3 Energy and how the microscopic world works 3.1 Quantum theory

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Source URL: puccini.che.pitt.edu

Language: English - Date: 2013-08-26 15:20:34
298Gibbs–Duhem equation / Statistical mechanics / Activity / Molecular dynamics / Chemical thermodynamics / Isothermal–isobaric ensemble / Thermodynamic free energy / Equation of state / Chemical potential / Chemistry / Thermodynamics / Physics

Fluid Phase Equilibria, [removed]Elsevier Scientific Publishing Company, 61 Amsterdam

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Source URL: tigger.uic.edu

Language: English - Date: 2002-01-12 04:30:28
299Molecular beam epitaxy / Semiconductor growth / Chemistry / Surface diffusion / Kinetic Monte Carlo / Stranski–Krastanov growth / Physics / Science / Materials science / Thin film deposition / Statistical mechanics

Competing roughening mechanisms in strained heteroepitaxy: a fast kinetic Monte Carlo study Chi-Hang Lam1 , Chun-Kin Lee1 , and Leonard M. Sander2 1 arXiv:cond-mat[removed]v2 5 Jul 2002

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Source URL: apricot.polyu.edu.hk

Language: English - Date: 2004-05-12 01:29:30
300Supramolecular chemistry / Molecular modelling / Molecular physics / Force field / Computational chemistry / DNA / Chemical bond / Quantum mechanics / Hydrogen bond / Chemistry / Chemical bonding / Intermolecular forces

XXXV Contents Acknowledgment VII Congratulations to Professor Ada Yonath for Winning the 2009 Nobel Prize in Chemistry IX

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Source URL: www.wiley-vch.de

Language: English - Date: 2010-01-28 21:03:31
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