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Journal of Computational Chemistry
Results: 126

#	Item
91	Copyright © 2013 American Scientiﬁc Publishers All rights reserved Printed in the United States of America Journal of Computational and Theoretical Nanoscience Add to Reading List Source URL: www.molecularassembler.com Language: English - Date: 2013-12-22 18:26:37 Mechanosynthesis Adamantane Chemical bonding Diamondoid Hydrogen bond Chemical reaction Hydrogen Chemistry Nanotechnology Chemical synthesis
92	Journal of The Electrochemical Society, 153 共11兲 H209-H216 共2006兲 H209[removed]153共11兲/H209/8/$20.00 © The Electrochemical Society Add to Reading List Source URL: enose.jpl.nasa.gov Language: English - Date: 2013-02-04 15:48:42 Analytical chemistry Pharmacology Computational chemistry Medicinal chemistry Quantitative structure–activity relationship Matrix Molecular descriptor Chemistry Cheminformatics Science
93	THE JOURNAL OF CHEMICAL PHYSICS 124, 094101 共2006兲 High precision variational calculations for the Born-Oppenheimer energies of the ground state of the hydrogen molecule James S. Simsa兲 National Institute of Stand Add to Reading List Source URL: www.nist.gov Language: English - Date: 2011-03-11 14:55:15 Quantum chemistry Configuration interaction ACES Variational method Chemistry Computational chemistry Theoretical chemistry
94	Journal of Computational Physics[removed]–85 www.elsevier.com/locate/jcp A pseudo-spectral multiscale method: Interfacial conditions and coarse grid equations Shaoqiang Tang Add to Reading List Source URL: users.cms.caltech.edu Language: English - Date: 2006-02-03 20:15:35 Thorn Science Computational chemistry Molecular dynamics Molecular modelling
95	Journal of Computational Methods in Sciences and Engineering[removed]–609 IOS Press 597 Computation and interpretation of Raman Add to Reading List Source URL: home.cc.umanitoba.ca Language: English - Date: 2011-01-10 15:41:53 Chemical physics Molecular modelling Raman scattering Spectroscopy Force field Molecular vibration Polarizability Chemistry Physics Science
96	Journal of The Electrochemical Society, 153 共11兲 H209-H216 共2006兲 H209[removed]153共11兲/H209/8/$20.00 © The Electrochemical Society Add to Reading List Source URL: enose.jpl.nasa.gov Language: English - Date: 2013-02-04 15:48:41 Analytical chemistry Pharmacology Computational chemistry Medicinal chemistry Quantitative structure–activity relationship Matrix Molecular descriptor Chemistry Cheminformatics Science
97	Volume 113, Number 3, May-June[removed]Journal of Research of the National Institute of Standards and Technology [J. Res. Natl. Inst. Stand. Technol. 113, [removed]Accelerating Scientific Discovery Add to Reading List Source URL: www.nist.gov Language: English - Date: 2010-11-12 15:51:46 Quantum chemistry Nanomaterials Atomic physics Computational chemistry Quantum dot Atomic orbital Tight binding Nanoparticle Wetting layer Chemistry Physics Chemical bonding
98	Journal of Computational Physics 149, 389–[removed]Article ID jcph[removed], available online at http://www.idealibrary.com on Using a Curvilinear Grid to Construct Symmetry-Preserving Discretizations for Lagrangian Add to Reading List Source URL: cnls.lanl.gov Language: English - Date: 2014-09-24 19:04:06 Symmetry Curvilinear coordinates Regular grid Crystal structure Polygon Lagrangian Physics Geometry Chemistry
99	THE UNIVERSITY OF BRITISH COLUMBIA SYNERGY » JOURNAL OF UBC SCIENCE ISSUE 1\|2006 2 Words from the Dean 3 Modelling Flux and Flow – Mathematical Analysis of Physical Processes Add to Reading List Source URL: science.ubc.ca Language: English - Date: 2008-10-15 19:33:54 Matter Neural networks Neuroscience Neural coding Gemstones Neural oscillation Beryl Crystallography Mathematical and theoretical biology Science Chemistry Computational neuroscience
100	THE JOURNAL OF CHEMICAL PHYSICS 124, 094101 共2006兲 High precision variational calculations for the Born-Oppenheimer energies of the ground state of the hydrogen molecule James S. Simsa兲 National Institute of Stand Add to Reading List Source URL: math.nist.gov Language: English - Date: 2006-03-08 13:21:40 Quantum chemistry Configuration interaction ACES Variational method Chemistry Computational chemistry Theoretical chemistry

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