Molecular mechanics

Results: 397



#Item
91Chemical engineering / Van der Waals equation / Gas / Equation of state / Molecular dynamics / Johannes Diderik van der Waals / Condensation / Magnetohydrodynamics / Maxwell construction / Physics / Fluid dynamics / Fluid mechanics

A three dimensional smooth particle hydrodynamics model of the nanoscale condensation of water

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Source URL: www.mssanz.org.au

Language: English - Date: 2013-01-15 22:37:04
92Quantum chemistry / Molecular physics / Ions / Quantum mechanics / Interatomic Coulombic Decay / Auger effect / Radioactive decay / Ionization energy / Ionization / Chemistry / Physics / Atomic physics

Photon Factory Activity Report 2004 #22 Part BAtomic and Molecular Science 3B,16B/2004G010 Observation of interatomic Coulombic decay in Ne dimer above and below the Ne

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Source URL: pfwww.kek.jp

Language: English - Date: 2010-01-05 10:31:36
93Molecular modelling / Dynamical systems / Structural analysis / Computational chemistry / Molecular dynamics / Hamiltonian mechanics / Buckling / Physics / Chemistry / Mechanics

CURRICULUM VITÆ John Henry Maddocks Born January 7, 1958. Citizen of the United Kingdom.

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Source URL: lcvmwww.epfl.ch

Language: English - Date: 2013-10-25 10:36:50
94Optics / Atomic physics / Ions / Molecular physics / Diffraction / Atom interferometer / Matter wave / Interferometric visibility / Anton Zeilinger / Physics / Chemistry / Wave mechanics

The wave nature of biomolecules and fluorofullerenes Lucia Hackerm¨ uller, Stefan Uttenthaler, Klaus Hornberger, Elisabeth Reiger, Bj¨orn Brezger,∗ Anton Zeilinger, and Markus Arndt arXiv:quant-ph/0309016v1 1 Sep 20

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Source URL: arxiv.org

Language: English - Date: 2008-02-01 01:58:40
95Fluid mechanics / Aerodynamics / Navier–Stokes equations / Couette flow / Viscosity / No-slip condition / Stress / Physics / Mechanics / Fluid dynamics

PHYSICAL REVIEW E 68, 016306 共2003兲 Molecular scale contact line hydrodynamics of immiscible flows Tiezheng Qian Department of Physics and Institute of Nano Science and Technology, The Hong Kong University of Scienc

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Source URL: www.math.ust.hk

Language: English - Date: 2003-09-16 09:03:25
96Quantum chemistry / Quantum mechanics / Chemical bonding / Spectroscopy / Atomic orbital / Electron / Ionization energy / Schrödinger equation / Molecular orbital / Physics / Chemistry / Atomic physics

PDF Document

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Source URL: ihome.ust.hk

Language: English - Date: 2011-05-17 17:48:44
97Rutherford Aris bibliography / Heinz Falk / Chemistry / Crystal / Walter Thiel

Publications: Prof. Dr. Walter ThielP. Sokkar, E. Boulanger, W. Thiel, and E. Sanchez-Garcia, J. Chem. Theory Comput. 11, ). Hybrid Quantum Mechanics/Molecular Mechanics/Coarse Grained Modeling

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Source URL: www.kofo.mpg.de

Language: English - Date: 2015-04-23 08:45:31
98Computational chemistry / Molecular modelling / Biophysics / Molecular dynamics / Quantum chemistry / Drug design / Enzyme / Quantum mechanics / Force field / Chemistry / Science / Theoretical chemistry

Invited Lectures 1) "The Azulene to Naphthalene Rearrangement", The University of Arkansas (Main Campus), Department of Chemistry, Jan) "The Azulene to Naphthalene Rearrangement", Northern Illinois University,

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Source URL: www.merzgroup.org

Language: English - Date: 2013-05-20 15:11:53
99Computational physics / Statistical mechanics / Monte Carlo method / Numerical analysis / Probabilistic complexity theory / Plasma / Fortran / Edgar Degas / Xi / Physics / Computing / Software engineering

Abstract This is the user’s manual for DEGAS 2 - A Monte Carlo code for the study of neutral atom and molecular transport in confined plasmas. It is intended to provide an introduction to DEGAS 2 from the user’s poin

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Source URL: w3.pppl.gov

Language: English - Date: 2015-03-25 15:29:17
100Computational chemistry / Classical mechanics / Spectroscopy / Force spectroscopy / Molecular dynamics / Fictitious force / Force / Constraint algorithm / Physics / Chemistry / Science

Journal of Biotechnology–23 Theoretical analysis of dynamic force spectroscopy experiments on ligand–receptor complexes M. Raible a , M. Evstigneev a , P. Reimann a,∗ , F.W. Bartels b , R. Ros b a

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Source URL: roslab.physics.asu.edu

Language: English - Date: 2010-01-04 11:29:45
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