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Computational and Theoretical Chemistry
Results: 190

#	Item
151	ComputationalTechniquesMethods_16p.A4_Feb11.indd Add to Reading List Source URL: www.esf.org Language: English - Date: 2011-04-27 12:10:59 Knowledge Engineering education Engineering physics European Science Foundation Computational Materials Science Materials science Computational mechanics Theoretical chemistry Computational Science and Engineering Science Computational science Chemistry
152	Personal Details Olga Papadodima, Ph.D., Functional Research Scientist Date and place of Birth: [removed], Athens Address National Hellenic Research Foundation (N.H.R.F.) Institute of Biology, Medicinal Chemistry and Bio Add to Reading List Source URL: www.eie.gr Language: English - Date: 2014-01-16 12:05:47 Biology Bioengineering Computational biology Mathematical and theoretical biology Molecular biology Systems biology Genomics Bioinformatics Applied mathematics Science
153	Michael J. M. Mazack 63 Kolthoff Hall 207 Pleasant St. SE Minneapolis, MN[removed]E-Mail: [removed] Add to Reading List Source URL: mazack.org Language: English - Date: 2014-06-09 15:45:15 World Association of Theoretical and Computational Chemists CHARMM Quantum mechanics Chemistry Molecular modelling Force fields
154	Want to write a review article for WIREs Computational Molecular Science? The journal content is managed strategically by our Editorial Board under the guidance of the Editor-in-Chief, and we usually approach carefully s Add to Reading List Source URL: media.wiley.com Language: English - Date: 2011-11-30 11:04:48 Theoretical chemistry Computational chemistry
155	University of Oslo EU Office at the Office for International Relations and Research Support “Destination Norway - Opportunities in ERC Research Funding” Organised by the EU Office, Department of Academic Administrati Add to Reading List Source URL: www.uio.no Language: English Centre for Theoretical and Computational Chemistry The Research Council of Norway Blindern Arvid Hallén ERC Science Oslo Norway Ole Petter Ottersen University of Oslo
156	Python Libraries for Computational Chemistry and Biology Andrew Dalke Dalke Scientific Software, LLC www.dalkescientific.com Add to Reading List Source URL: www.dalkescientific.com Language: English - Date: 2005-07-25 03:57:12 Cheminformatics Chemical bond Quantum chemistry Molecular graph Benzene Capsaicin Computational chemistry Valence Aromatic ring current Chemistry Theoretical chemistry Chemical bonding
157	rsta.royalsocietypublishing.org Excited states properties of organic molecules: from density functional theory to the GW and Bethe–Salpeter Add to Reading List Source URL: attaccalite.altervista.org Language: English - Date: 2014-02-25 16:00:56 Computational chemistry Theoretical chemistry Density functional theory Computational physics Hybrid functional Crystal Time-dependent density functional theory Hartree–Fock method Electronic band structure Chemistry Physics Quantum chemistry
158	Copyright © 2011 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.helcorp.com Language: English - Date: 2014-01-16 16:15:26 Mechanosynthesis Chemical bonding Quantum chemistry Tooltip Hydrogen bond Lead(II) chloride Chemical bond Bond order Chemistry Nanotechnology Chemical synthesis
159	LOWDIN’S REMARKS ON THE AUFBAU PRINCIPLE AND A PHILOSOPHER’S VIEW OF AB INITIO QUANTUM CHEMISTRY Add to Reading List Source URL: www.chem.ucla.edu Language: English - Date: 2003-10-27 15:48:09 Atomic physics Quantum chemistry Computational chemistry Quantum mechanics Ab initio quantum chemistry methods Electron configuration Aufbau principle Hartree–Fock method Atomic orbital Chemistry Physics Theoretical chemistry
160	Have Orbitals Really Been Observed? Eric R. Scerri Department of Chemistry and Biochemistry, UCLA, Los Angeles, CA 90095; [removed] The purpose of this article is to comment on the pedagogical ramifications of Add to Reading List Source URL: www.chem.ucla.edu Language: English - Date: 2000-09-25 18:35:54 Chemical bonding Theoretical chemistry Computational chemistry Atomic physics Molecular orbital Atomic orbital Electron configuration Hartree–Fock method Chemical bond Chemistry Physics Quantum chemistry

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