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The first microsolvation step for furans: New experiments and benchmarking strategies.
Gottschalk, Hannes C; Poblotzki, Anja; Fatima, Mariyam; Obenchain, Daniel A; Pérez, Cristóbal; Antony, Jens; Auer, Alexander A; Baptista, Leonardo; Benoit, David M; Bistoni, Giovanni; Bohle, Fabian; Dahmani, Rahma; Firaha, Dzmitry; Grimme, Stefan; Hansen, Andreas; Harding, Michael E; Hochlaf, Majdi; Holzer, Christof; Jansen, Georg; Klopper, Wim; Kopp, Wassja A; Krasowska, Malgorzata; Kröger, Leif C; Leonhard, Kai; Mogren Al-Mogren, Muneerah; Mouhib, Halima; Neese, Frank; Pereira, Max N; Prakash, Muthuramalingam; Ulusoy, Inga S; Mata, Ricardo A; Suhm, Martin A; Schnell, Melanie.
Afiliación
  • Gottschalk HC; Institut für Physikalische Chemie, Universität Göttingen, Tammannstr. 6, 37077 Göttingen, Germany.
  • Poblotzki A; Institut für Physikalische Chemie, Universität Göttingen, Tammannstr. 6, 37077 Göttingen, Germany.
  • Fatima M; Deutsches Elektronen-Synchrotron, Notkestr. 85, 22607 Hamburg, Germany.
  • Obenchain DA; Deutsches Elektronen-Synchrotron, Notkestr. 85, 22607 Hamburg, Germany.
  • Pérez C; Deutsches Elektronen-Synchrotron, Notkestr. 85, 22607 Hamburg, Germany.
  • Antony J; Mulliken Center for Theoretical Chemistry, Universität Bonn, Beringstrasse 4, 53115 Bonn, Germany.
  • Auer AA; Department of Molecular Theory and Spectroscopy, Max Planck Institute for Chemical Energy Conversion, Stiftstr. 34-36, 45470 Mülheim an der Ruhr, Germany.
  • Baptista L; Departamento de Química e Ambiental, Universidade do Estado do Rio de Janeiro, Faculdade de Tecnologia, Resende, RJ, Brazil.
  • Benoit DM; Department of Physics and Mathematics, E. A. Milne Centre for Astrophysics and G. W. Gray Centre for Advanced Materials Chemistry, University of Hull, Hull HU6 7RX, United Kingdom.
  • Bistoni G; Department of Molecular Theory and Spectroscopy, Max Planck Institute for Chemical Energy Conversion, Stiftstr. 34-36, 45470 Mülheim an der Ruhr, Germany.
  • Bohle F; Mulliken Center for Theoretical Chemistry, Universität Bonn, Beringstrasse 4, 53115 Bonn, Germany.
  • Dahmani R; Université Gustave Eiffel, COSYS/LISIS, 5 Blvd. Descartes, 77454 Marne-La-Vallée, France.
  • Firaha D; Lehrstuhl für Technische Thermodynamik, RWTH Aachen University, 52062 Aachen, Germany.
  • Grimme S; Mulliken Center for Theoretical Chemistry, Universität Bonn, Beringstrasse 4, 53115 Bonn, Germany.
  • Hansen A; Mulliken Center for Theoretical Chemistry, Universität Bonn, Beringstrasse 4, 53115 Bonn, Germany.
  • Harding ME; Institute of Nanotechnology, Karlsruhe Institute of Technology, Hermann-von-Helmholtz-Platz 1, 76344 Eggenstein-Leopoldshafen, Germany.
  • Hochlaf M; Université Gustave Eiffel, COSYS/LISIS, 5 Blvd. Descartes, 77454 Marne-La-Vallée, France.
  • Holzer C; Theoretical Chemistry Group, Institute of Physical Chemistry, Karlsruhe Institute of Technology (KIT), P.O. Box 6980, 76049 Karlsruhe, Germany.
  • Jansen G; Fakultät für Chemie, Universität Duisburg-Essen, Universitätsstr. 5, 45117 Essen, Germany.
  • Klopper W; Theoretical Chemistry Group, Institute of Physical Chemistry, Karlsruhe Institute of Technology (KIT), P.O. Box 6980, 76049 Karlsruhe, Germany.
  • Kopp WA; Lehrstuhl für Technische Thermodynamik, RWTH Aachen University, 52062 Aachen, Germany.
  • Krasowska M; Department of Molecular Theory and Spectroscopy, Max Planck Institute for Chemical Energy Conversion, Stiftstr. 34-36, 45470 Mülheim an der Ruhr, Germany.
  • Kröger LC; Lehrstuhl für Technische Thermodynamik, RWTH Aachen University, 52062 Aachen, Germany.
  • Leonhard K; Lehrstuhl für Technische Thermodynamik, RWTH Aachen University, 52062 Aachen, Germany.
  • Mogren Al-Mogren M; Chemistry Department, Faculty of Science, King Saud University, P.O. Box 2455, Riyadh 11451, Kingdom of Saudi Arabia.
  • Mouhib H; Université Gustave Eiffel, COSYS/LISIS, 5 Blvd. Descartes, 77454 Marne-La-Vallée, France.
  • Neese F; Department of Molecular Theory and Spectroscopy, Max Planck Institute for Chemical Energy Conversion, Stiftstr. 34-36, 45470 Mülheim an der Ruhr, Germany.
  • Pereira MN; Departamento de Química e Ambiental, Universidade do Estado do Rio de Janeiro, Faculdade de Tecnologia, Resende, RJ, Brazil.
  • Prakash M; Department of Chemistry, SRM Institute of Science and Technology, Kattankulathur 603 203, Tamil Nadu, India.
  • Ulusoy IS; Theoretical Chemistry, Institute of Physical Chemistry, Heidelberg University, Im Neuenheimer Feld 229, 69120 Heidelberg, Germany.
  • Mata RA; Institut für Physikalische Chemie, Universität Göttingen, Tammannstr. 6, 37077 Göttingen, Germany.
  • Suhm MA; Institut für Physikalische Chemie, Universität Göttingen, Tammannstr. 6, 37077 Göttingen, Germany.
  • Schnell M; Deutsches Elektronen-Synchrotron, Notkestr. 85, 22607 Hamburg, Germany.
J Chem Phys ; 152(16): 164303, 2020 Apr 30.
Article en En | MEDLINE | ID: mdl-32357787
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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: J Chem Phys Año: 2020 Tipo del documento: Article País de afiliación: Alemania Pais de publicación: Estados Unidos
Texto completo
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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: J Chem Phys Año: 2020 Tipo del documento: Article País de afiliación: Alemania Pais de publicación: Estados Unidos