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Ab Initio
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111	Achievements & Prospects \| Scientific Report \| Supplements Nanometric Devices Calculated ab-initio [1] Z. Xu & al. Add to Reading List Source URL: www.fondation-nanosciences.fr Language: English - Date: 2014-07-21 04:01:38
112	Hydrogen Isotope Equilibration Induced by Tritium Radiation – Ab Initio Approach to Reaction Kinetics A.B. Sazonova,, E.P. Magomedbekov a a D. Mendeleyev University of Chemical Technology of Russia, 9-th Miusskaya sq Add to Reading List Source URL: tritium2010.nifs.ac.jp Language: English* - Date: 2010-09-24 04:08:59
113	79 THE DETERMINATION OF TERMODYNAMIC POTENTIALS OF SUBSTANCES BY AB-INITIO CALCULATIONS M.F.Vigasina, R.Yu.Orlov MSU by M.V.Lomonosov, Geological Faculty This study was supported by the Russian Fundamental Research Found Add to Reading List Source URL: geo.web.ru Language: English - Date: 2002-12-30 14:08:45
114	WIKINIZER™ RESEARCH: A PERSONAL KNOWLEDGE GRAPH BUILDER HARNESSING FREEBASE LINKED DATA G Lajos (United Kingdom) and András G. Benedek (Hungary) ABSTRACT WIKINIZER™ RESEARCH (http://wikinizer.com) is a visual Wiki-l Add to Reading List Source URL: linkedup-project.eu Language: English - Date: 2014-12-22 03:36:06 Ab Initio Workflow Graph Information technology management Mathematics Knowledge representation Data management Graph theory Freebase
115	T he CEA-EDF-Inria Summer Schools offer high-level training in numerical analysis Add to Reading List Source URL: www-hpc.cea.fr Language: English - Date: 2013-04-03 04:14:28 France Parallel computing Wen-mei Hwu Ab Initio ParisTech Computing Academia 6th arrondissement of Paris Paris Institute of Technology École des Ponts ParisTech
116	Use of Ab Initio Calculations to Help Interpret the UV-Visible Spectra of Aquavanadium Complexes Add to Reading List Source URL: staff.ycp.edu Language: English - Date: 2014-06-03 13:47:46 Quantum chemistry Chemical bonding Coordination chemistry Vanadium Tanabe-Sugano diagram Atomic orbital Ligand field theory Coordination complex Electron configuration Chemistry Transition metals Inorganic chemistry
117	IMPRS Block Course „Complex Surfaces in Materials Science“ October 4 – 5, and October 8-10, 2012 ThursdayPhys.Chem.-Department at the FHI Add to Reading List Source URL: www.imprs-cs.mpg.de Language: English - Date: 2012-09-21 05:17:24 Cluster chemistry ACES Inorganic chemistry Ab initio quantum chemistry methods Spectroscopy Chemistry Science Theoretical chemistry
118	Goldschmidt 2000 September 3rd–8th, 2000 Oxford, UK. Journal of Conference Abstracts Volume 5(2), 818 Add to Reading List Source URL: www.the-conference.com Language: English - Date: 2009-11-05 07:07:52 Molecular dynamics Ab initio Science Structure of the Earth Geomagnetism Outer core
119	Pure & Appl. Chem.,Vol. 68, No. 2, pp, 1996. Printed in Great Britain. INTERNATIONAL UNION OF PURE AND APPLIED CHEMISTRY PHYSICAL CHEMISTRY DIVISION Add to Reading List Source URL: old.iupac.org Language: English - Date: 2004-06-03 11:40:20 Computational chemistry Hartree–Fock method Crystal Molecular orbital theory Ab initio quantum chemistry methods Electronic correlation Coupled cluster Molecular orbital Full configuration interaction Chemistry Quantum chemistry Theoretical chemistry
120	Workshop on Nanoscience for Solar Energy ConversionOctoberDynamics on the Nanoscale: Time-domain ab initio studies of quantum dots and Add to Reading List Source URL: portal.ictp.it Language: English - Date: 2009-09-14 11:24:41 Quantum mechanics Theoretical chemistry Computational chemistry Molecular dynamics Molecular modelling Diabatic Carbon nanotube Chemistry Physics Quantum chemistry