Result Number | Material Type | Add to My Shelf Action | Record Details and Options |
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1 |
Material Type: Article
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TD-DFT benchmarks: A reviewInternational journal of quantum chemistry, 2013-09, Vol.113 (17), p.2019-2039 [Peer Reviewed Journal]2013 Wiley Periodicals, Inc. ;Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24438 ;CODEN: IJQCB2Full text available |
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2 |
Material Type: Article
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Effects of different initial condition samplings on photodynamics and spectrum of pyrroleInternational journal of quantum chemistry, 2016-05, Vol.116 (10), p.762-771 [Peer Reviewed Journal]2015 Wiley Periodicals, Inc. ;Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.25049 ;CODEN: IJQCB2Full text available |
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3 |
Material Type: Article
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Progress in Understanding Low-Temperature Organic Compound Oxidation Using a Jet-Stirred ReactorInternational journal of chemical kinetics, 2014-10, Vol.46 (10), p.619-639 [Peer Reviewed Journal]2014 Wiley Periodicals, Inc. ;Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0538-8066 ;EISSN: 1097-4601 ;DOI: 10.1002/kin.20871 ;CODEN: IJCKBOFull text available |
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4 |
Material Type: Article
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Peter Komadel, 1955–2021Clay minerals, 2021-03, Vol.56 (1), p.85-86 [Peer Reviewed Journal]Copyright © The Author(s), 2021. Published by Cambridge University Press on behalf of The Mineralogical Society of Great Britain and Ireland ;ISSN: 0009-8558 ;EISSN: 1471-8030 ;DOI: 10.1180/clm.2021.11Full text available |
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5 |
Material Type: Article
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Conformational Study and Chiroptical Properties of Chiral Dimethyl-Ethylenedithio-Tetrathiafulvalene (DM-EDT-TTF)Chimia, 2018-06, Vol.72 (6), p.389-393 [Peer Reviewed Journal]Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0009-4293 ;EISSN: 2673-2424 ;DOI: 10.2533/chimia.2018.389 ;PMID: 29941074Full text available |
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6 |
Material Type: Article
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Rate Constants of the Reactions of O( 3 P) Atoms with Ethene and Propene over the Temperature Range 230-900 KInternational journal of chemical kinetics, 2017, Vol.49 (1), p.53-60 [Peer Reviewed Journal]Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0538-8066 ;EISSN: 1097-4601 ;DOI: 10.1002/kin.21056Digital Resources/Online E-Resources |
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7 |
Material Type: Article
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Gaussian continuum basis functions for calculating high-harmonic generation spectraInternational journal of quantum chemistry, 2016-07, Vol.116 (14), p.1120-1131 [Peer Reviewed Journal]2016 Wiley Periodicals, Inc. ;Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.25146 ;CODEN: IJQCB2Full text available |
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8 |
Material Type: Book
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Viscosity of Liquids: Theory, Estimation, Experiment, and DataSpringer 2007 ;ISBN: 1402054815 ;ISBN: 9781402054815 ;EISBN: 1402054823 ;EISBN: 9781402054822 ;DOI: 10.1007/978-1-4020-5482-2 ;OCLC: 187915231Full text available |
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9 |
Material Type: Article
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Kinetic and Mechanistic Study of the Thermal Decomposition of Ethyl NitrateInternational journal of chemical kinetics, 2017-05, Vol.49 (5), p.354-362 [Peer Reviewed Journal]Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0538-8066 ;EISSN: 1097-4601 ;DOI: 10.1002/kin.21080Digital Resources/Online E-Resources |
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10 |
Material Type: Article
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Estimating local bonding/antibonding character of canonical molecular orbitals from their energy derivatives. The case of coordinating lone pair orbitalsInternational journal of quantum chemistry, 2016-09, Vol.116 (17), p.1285-1295 [Peer Reviewed Journal]2016 Wiley Periodicals, Inc. ;Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.25174 ;CODEN: IJQCB2Full text available |
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11 |
Material Type: Book
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Lithium-Ion Batteries: Science and TechnologiesSpringer Science+Business Media, LLC 2009 ;ISBN: 0387344446 ;ISBN: 9780387344447 ;EISBN: 9780387344454 ;EISBN: 0387344454 ;DOI: 10.1007/978-0-387-34445-4 ;OCLC: 654391395Full text available |
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12 |
Material Type: Article
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Direct Measurement of the Equilibrium Constants of the Reaction of Formaldehyde and Acetaldehyde with HO2 RadicalsInternational journal of chemical kinetics, 2014-05, Vol.46 (5), p.245-259 [Peer Reviewed Journal]2013 Wiley Periodicals, Inc. ;ISSN: 0538-8066 ;EISSN: 1097-4601 ;DOI: 10.1002/kin.20817 ;CODEN: IJCKBOFull text available |
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13 |
Material Type: Book
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Pillared Clays and Related CatalystsSpringer-Verlag New York 2010 ;ISBN: 1441966692 ;ISBN: 9781441966698 ;ISBN: 9781489982353 ;ISBN: 1489982353 ;EISBN: 9781441966704 ;EISBN: 1441966706 ;DOI: 10.1007/978-1-4419-6670-4 ;OCLC: 676697647Full text available |
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14 |
Material Type: Book
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Reaction-Transport Systems: Mesoscopic Foundations, Fronts, and Spatial InstabilitiesSpringer-Verlag Berlin Heidelberg 2010 ;ISSN: 0172-7389 ;ISBN: 9783642114434 ;ISBN: 3642114431 ;ISBN: 3642114423 ;ISBN: 9783642114427 ;EISBN: 9783642114434 ;EISBN: 3642114431 ;DOI: 10.1007/978-3-642-11443-4 ;OCLC: 654382056Full text available |
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15 |
Material Type: Article
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Ab initio simulations of two-dimensional electronic spectra: The SOS//QM/MM approachInternational journal of quantum chemistry, 2014-01, Vol.114 (2), p.85-93 [Peer Reviewed Journal]Copyright © 2013 Wiley Periodicals, Inc. ;Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24511 ;CODEN: IJQCB2Full text available |
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16 |
Material Type: Article
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Computational Kinetic Study for the Unimolecular Decomposition of CyclopentanoneInternational journal of chemical kinetics, 2015-07, Vol.47 (7), p.439-446 [Peer Reviewed Journal]2015 Wiley Periodicals, Inc. ;Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0538-8066 ;EISSN: 1097-4601 ;DOI: 10.1002/kin.20921 ;CODEN: IJCKBOFull text available |
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17 |
Material Type: Article
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Ozonolysis of a Series of Methylated Alkenes: Reaction Rate Coefficients and Gas-Phase ProductsInternational journal of chemical kinetics, 2015-09, Vol.47 (9), p.596-605 [Peer Reviewed Journal]2015 Wiley Periodicals, Inc. ;Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0538-8066 ;EISSN: 1097-4601 ;DOI: 10.1002/kin.20934 ;CODEN: IJCKBOFull text available |
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18 |
Material Type: Article
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Charge Ordering in Cobalt Oxides: Impact on Structure, Magnetic and Transport PropertiesZeitschrift für anorganische und allgemeine Chemie (1950), 2015-07, Vol.641 (8-9), p.1385-1394 [Peer Reviewed Journal]Copyright © 2015 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim ;Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0044-2313 ;EISSN: 1521-3749 ;DOI: 10.1002/zaac.201500085Full text available |
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19 |
Material Type: Article
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NMR characterization of dilauroyl phosphatidylcholine in adsorbed monolayers at fluid interfaces studied by multiscale computationsInternational journal of quantum chemistry, 2016-10, Vol.116 (19), p.1419-1426 [Peer Reviewed Journal]2016 Wiley Periodicals, Inc. ;Distributed under a Creative Commons Attribution 4.0 International License ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.25198 ;CODEN: IJQCB2Full text available |
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20 |
Material Type: Article
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Preparation of Cu(II) ions adsorbent from acrylic acid-grafted corn starch in aqueous solutionsStarch - Stärke, 2013-05, Vol.65 (5-6), p.417-424 [Peer Reviewed Journal]Copyright © 2013 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim ;ISSN: 0038-9056 ;EISSN: 1521-379X ;DOI: 10.1002/star.201200051Full text available |