Theoretical chemistry

Results: 969



#Item
211Scientific method / High-performance liquid chromatography / Simulated moving bed / Gas chromatography / Size-exclusion chromatography / Supercritical fluid chromatography / Elution / Theoretical plate / Ion chromatography / Chemistry / Chromatography / Science

PDF Document

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Source URL: media.wiley.com

Language: English - Date: 2007-10-05 22:45:56
212Environment / Environmental chemistry / Oxygen / Disinfectants / Gases / Ozone / NPOESS Preparatory Project / Ozone depletion / Earth / Chemistry

ALGORITHM THEORETICAL BASIS DOCUMENT (ATBD)

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Source URL: macuv.gsfc.nasa.gov

Language: English - Date: 2014-10-08 23:44:03
213Density functional theory / Functional

Nagoya University Platform: Theoretical Nano-Energy Chemistry Colloquium

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Source URL: www.rcms.nagoya-u.ac.jp

Language: English - Date: 2015-04-17 00:32:05
214Computational 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
215Density functional theory / Crystal / Ab initio quantum chemistry methods / Møller–Plesset perturbation theory / Design for testing / Hybrid functional / Dalton / Chemistry / Theoretical chemistry / Computational chemistry

Dalton Transactions View Article Online PAPER

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Source URL: www.claudiocazorla.com

Language: English - Date: 2013-03-06 12:48:07
216Computational chemistry / Theoretical chemistry / Chemist / Quantum chemistry

Microsoft Word - 19_COMP_S_C

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Source URL: oldwww.acscomp.org

Language: English - Date: 2011-07-01 06:30:49
217Environmental chemistry / Materials science / Spectroscopy / XANES / Hydrogenase / Physics / Science / Chemistry / Condensed matter physics

Nagoya University Theoretical Chemistry Colloquium June 19, 2013 (Wed), 14:00-15:30 RCMS, 2nd floor, Chemistry Gallery

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Source URL: www.rcms.nagoya-u.ac.jp

Language: English - Date: 2015-04-17 00:31:53
218Chemist / Theoretical chemistry / Nucleation / Science / Chemistry / Cluster chemistry / Polyoxometalate

Nagoya University Platform: Nano/Energy Theoretical Chemistry Colloquium Aug. 29, 2013 (Thu), 16:00-17:00

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Source URL: www.rcms.nagoya-u.ac.jp

Language: English - Date: 2015-04-17 00:31:53
219Quantum chemistry / Atomic physics / Crystal / Numerical analysis / Gaussian / Density functional theory / Ab initio quantum chemistry methods / Basis set / Fast multipole method / Chemistry / Theoretical chemistry / Computational chemistry

RICE UNIVERSITY Linear Scaling Density Functional Theory with Gaussian Orbitals and Periodic Boundary Conditions by

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Source URL: scuseria.rice.edu

Language: English - Date: 2006-05-03 17:46:09
220Quantum chemistry / Molecular physics / Molecular modelling / Molecular orbital / Linear combination of atomic orbitals / Gaussian orbital / Force field / Quantitative structure–activity relationship / Drug design / Chemistry / Theoretical chemistry / Computational chemistry

Pure&Appl. Chem.,Vol. 69, No. 5, pp, 1997. Printed in Great BritainIUPAC INTERNATIONAL UNION OF PURE AND APPLIED CHEMISTRY

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Source URL: old.iupac.org

Language: English
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