부산대학교 도서관

Zyuzin, D. A.; Karpova, A. V.; Kirichenko, A. Yu.; Shibanov, Yu. A.; Bikmaev, I. F.; Gilfanov, M. R.; Irtuganov, E. N.; Gorbachev, M. A.; Suslikov, M. V.; Karimov, R.; Veryazov, M. M.; Pereyra, M.

Larsson, E D; Zobel, J P; Veryazov, V

Electronic Structure Towards a multiconfigurational description of the electronic structure in solids. 4(1)

Nalikowski, K.; Krośnicki, M.; Veryazov, V.; Beeks, K.; Schumm, T.

In: Physical Review B. (Physical Review B, 15 March 2025, 111(11))

Karlstrom G; Lindh R; Malmqvist PA; Roos BO; Ryde U; Veryazov V; Widmark PO; Schimmelpfennig B; Neogrady P; Seijo L.; COSSI, Maurizio

Computational Materials Science. 28:222-239

Aquilante F.; De Vico L.; Ferré N.; GHIGO, Giovanni; Malmqvist P. Å.; Neogrády P.; Pedersen T. B.; Pitoňák M.; Reiher M.; Roos B. O.; Serrano Andrés L.; Urban M.; Veryazov V.; Lindh R.

Journal of Computational Chemistry. 31:224-247

Kocherbitov V; Department of Biomedical Science, Faculty of Health and Society, Malmö University, SE-205 06 Malmö, Sweden.; Biofilms Research Center for Biointerfaces, Malmö University, SE-205 06 Malmö, Sweden.; Music D; Biofilms Research Center for Biointerfaces, Malmö University, SE-205 06 Malmö, Sweden.; Department of Materials Science and Applied Mathematics, Faculty of Technology and Society, Malmö University, SE-205 06 Malmö, Sweden.; Veryazov V; Computational Chemistry, Kemicentrum, Lund University, P.O. Box 124, SE-22100 Lund, Sweden.

Publisher: American Institute of Physics Country of Publication: United States NLM ID: 0375360 Publication Model: Print Cited Medium: Internet ISSN: 1089-7690 (Electronic) Linking ISSN: 00219606 NLM ISO Abbreviation: J Chem Phys Subsets: PubMed not MEDLINE; MEDLINE

Li Manni G; Electronic Structure Theory Department, Max Planck Institute for Solid State Research, Heisenbergstraße 1, 70569 Stuttgart, Germany.; Fdez Galván I; Department of Chemistry - BMC, Uppsala University, P.O. Box 576, SE-75123 Uppsala, Sweden.; Alavi A; Electronic Structure Theory Department, Max Planck Institute for Solid State Research, Heisenbergstraße 1, 70569 Stuttgart, Germany.; Yusuf Hamied Department of Chemistry, University of Cambridge, Lensfield Road, Cambridge CB2 1EW, United Kingdom.; Aleotti F; Department of Industrial Chemistry 'Toso Montanari', University of Bologna, 40136 Bologna, Italy.; Aquilante F; Theory and Simulation of Materials (THEOS) and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), École Polytechnique Fédérale de Lausanne (EPFL), CH-1015 Lausanne, Switzerland.; Autschbach J; Department of Chemistry, University at Buffalo, State University of New York, Buffalo, New York 14260-3000, United States.; Avagliano D; Department of Industrial Chemistry 'Toso Montanari', University of Bologna, 40136 Bologna, Italy.; Baiardi A; ETH Zurich, Laboratory for Physical Chemistry, Vladimir-Prelog-Weg 2, 8093 Zurich, Switzerland.; Bao JJ; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Battaglia S; Department of Chemistry - BMC, Uppsala University, P.O. Box 576, SE-75123 Uppsala, Sweden.; Birnoschi L; The Department of Chemistry, The University of Manchester, M13 9PL, Manchester, U.K.; Blanco-González A; Chemistry Department, Bowling Green State University, Overmann Hall, Bowling Green, Ohio 43403, United States.; Bokarev SI; Institut für Physik, Universität Rostock, Albert-Einstein-Str. 23-24, 18059 Rostock, Germany.; Chemistry Department, School of Natural Sciences, Technical University of Munich, Lichtenbergstr. 4, 85748 Garching, Germany.; Broer R; Theoretical Chemistry, Zernike Institute for Advanced Materials, University of Groningen, Nijenborgh 4, 9747AG Groningen, The Netherlands.; Cacciari R; Dipartimento di Biotecnologie, Chimica e Farmacia, Università di Siena, Via A. Moro 2, 53100 Siena, Italy.; Calio PB; Department of Chemistry, Pritzker School of Molecular Engineering, James Franck Institute, Chicago Center for Theoretical Chemistry, The University of Chicago, Chicago, Illinois 60637, United States.; Carlson RK; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Carvalho Couto R; Division of Theoretical Chemistry and Biology, School of Engineering Sciences in Chemistry, Biotechnology and Health, KTH Royal Institute of Technology, SE-106 91 Stockholm, Sweden.; Cerdán L; Instituto de Ciencia Molecular, Universitat de València, Catedrático José Beltrán Martínez n. 2, 46980 Paterna, Spain.; Instituto de Óptica (IO-CSIC), Consejo Superior de Investigaciones Científicas, 28006, Madrid, Spain.; Chibotaru LF; Department of Chemistry, KU Leuven, Celestijnenlaan 200F, 3001 Leuven, Belgium.; Chilton NF; The Department of Chemistry, The University of Manchester, M13 9PL, Manchester, U.K.; Church JR; Institute of Chemistry, The Hebrew University of Jerusalem, Jerusalem 91904, Israel.; Conti I; Department of Industrial Chemistry 'Toso Montanari', University of Bologna, 40136 Bologna, Italy.; Coriani S; Department of Chemistry, Technical University of Denmark, Kemitorvet Bldg 207, 2800 Kongens Lyngby, Denmark.; Cuéllar-Zuquin J; Instituto de Ciencia Molecular, Universitat de València, Catedrático José Beltrán Martínez n. 2, 46980 Paterna, Spain.; Daoud RE; Dipartimento di Biotecnologie, Chimica e Farmacia, Università di Siena, Via A. Moro 2, 53100 Siena, Italy.; Dattani N; HPQC Labs, Waterloo, N2T 2K9 Ontario Canada.; HPQC College, Waterloo, N2T 2K9 Ontario Canada.; Decleva P; Istituto Officina dei Materiali IOM-CNR and Dipartimento di Scienze Chimiche e Farmaceutiche, Università degli Studi di Trieste, I-34121 Trieste, Italy.; de Graaf C; Department of Physical and Inorganic Chemistry, Universitat Rovira i Virgili, Tarragona 43007, Spain.; ICREA, Pg. Lluís Companys 23, 08010 Barcelona, Spain.; Delcey MG; Division of Theoretical Chemistry and Biology, School of Engineering Sciences in Chemistry, Biotechnology and Health, KTH Royal Institute of Technology, SE-106 91 Stockholm, Sweden.; De Vico L; Dipartimento di Biotecnologie, Chimica e Farmacia, Università di Siena, Via A. Moro 2, 53100 Siena, Italy.; Dobrautz W; Chalmers University of Technology, Department of Chemistry and Chemical Engineering, 41296 Gothenburg, Sweden.; Dong SS; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Department of Chemistry and Chemical Biology, Department of Physics, and Department of Chemical Engineering, Northeastern University, Boston, Massachusetts 02115, United States.; Feng R; Department of Chemistry, University at Buffalo, State University of New York, Buffalo, New York 14260-3000, United States.; Department of Chemistry, Fudan University, Shanghai 200433, China.; Ferré N; Institut de Chimie Radicalaire (UMR-7273), Aix-Marseille Univ, CNRS, ICR 13013 Marseille, France.; Filatov Gulak M; Department of Chemistry, Kyungpook National University, Daegu 702-701, South Korea.; Gagliardi L; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Department of Chemistry, Pritzker School of Molecular Engineering, James Franck Institute, Chicago Center for Theoretical Chemistry, The University of Chicago, Chicago, Illinois 60637, United States.; Garavelli M; Department of Industrial Chemistry 'Toso Montanari', University of Bologna, 40136 Bologna, Italy.; González L; Institute of Theoretical Chemistry, Faculty of Chemistry, University of Vienna, Währinger Straße 17, A-1090 Vienna, Austria.; Guan Y; State Key Laboratory of Molecular Reaction Dynamics and Center for Theoretical Computational Chemistry, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Dalian 116023, People's Republic of China.; Guo M; SSRL, SLAC National Accelerator Laboratory, Menlo Park, California 94025, United States.; Hennefarth MR; Department of Chemistry, Pritzker School of Molecular Engineering, James Franck Institute, Chicago Center for Theoretical Chemistry, The University of Chicago, Chicago, Illinois 60637, United States.; Hermes MR; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Department of Chemistry, Pritzker School of Molecular Engineering, James Franck Institute, Chicago Center for Theoretical Chemistry, The University of Chicago, Chicago, Illinois 60637, United States.; Hoyer CE; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Department of Chemistry, University of Washington, Seattle, Washington 98195, United States.; Huix-Rotllant M; Institut de Chimie Radicalaire (UMR-7273), Aix-Marseille Univ, CNRS, ICR 13013 Marseille, France.; Jaiswal VK; Department of Industrial Chemistry 'Toso Montanari', University of Bologna, 40136 Bologna, Italy.; Kaiser A; Institut für Physik, Universität Rostock, Albert-Einstein-Str. 23-24, 18059 Rostock, Germany.; Kaliakin DS; Chemistry Department, Bowling Green State University, Overmann Hall, Bowling Green, Ohio 43403, United States.; Khamesian M; Department of Chemistry - BMC, Uppsala University, P.O. Box 576, SE-75123 Uppsala, Sweden.; King DS; Department of Chemistry, Pritzker School of Molecular Engineering, James Franck Institute, Chicago Center for Theoretical Chemistry, The University of Chicago, Chicago, Illinois 60637, United States.; Kochetov V; Institut für Physik, Universität Rostock, Albert-Einstein-Str. 23-24, 18059 Rostock, Germany.; Krośnicki M; Institute of Theoretical Physics and Astrophysics, Faculty of Mathematics, Physics and Informatics, University of Gdańsk, ul Wita Stwosza 57, 80-952, Gdańsk, Poland.; Kumaar AA; HPQC Labs, Waterloo, N2T 2K9 Ontario Canada.; Larsson ED; Division of Theoretical Chemistry, Chemical Centre, Lund University, P.O. Box 124, SE-22100, Lund, Sweden.; Lehtola S; Molecular Sciences Software Institute, Blacksburg, Virginia 24061, United States.; Department of Chemistry, University of Helsinki, P.O. Box 55, FI-00014 University of Helsinki, Finland.; Lepetit MB; Condensed Matter Theory Group, Institut Néel, CNRS UPR 2940, 38042 Grenoble, France.; Theory Group, Institut Laue Langevin, 38042 Grenoble, France.; Lischka H; Department of Chemistry and Biochemistry, Texas Tech University, Lubbock, Texas 79409-1061, United States.; López Ríos P; Electronic Structure Theory Department, Max Planck Institute for Solid State Research, Heisenbergstraße 1, 70569 Stuttgart, Germany.; Lundberg M; Department of Chemistry - Ångström Laboratory, Uppsala University, SE-75120 Uppsala, Sweden.; Ma D; Electronic Structure Theory Department, Max Planck Institute for Solid State Research, Heisenbergstraße 1, 70569 Stuttgart, Germany.; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Mai S; Institute of Theoretical Chemistry, Faculty of Chemistry, University of Vienna, Währinger Straße 17, A-1090 Vienna, Austria.; Marquetand P; Institute of Theoretical Chemistry, Faculty of Chemistry, University of Vienna, Währinger Straße 17, A-1090 Vienna, Austria.; Merritt ICD; Nantes Université, CNRS, CEISAM, UMR 6230, F-44000 Nantes, France.; Montorsi F; Department of Industrial Chemistry 'Toso Montanari', University of Bologna, 40136 Bologna, Italy.; Mörchen M; ETH Zurich, Laboratory for Physical Chemistry, Vladimir-Prelog-Weg 2, 8093 Zurich, Switzerland.; Nenov A; Department of Industrial Chemistry 'Toso Montanari', University of Bologna, 40136 Bologna, Italy.; Nguyen VHA; Department of Chemistry, National University of Singapore, 3 Science Drive 3, 117543 Singapore.; Nishimoto Y; Graduate School of Science, Kyoto University, Kyoto 606-8502, Japan.; Oakley MS; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Olivucci M; Chemistry Department, Bowling Green State University, Overmann Hall, Bowling Green, Ohio 43403, United States.; Dipartimento di Biotecnologie, Chimica e Farmacia, Università di Siena, Via A. Moro 2, 53100 Siena, Italy.; Oppel M; Institute of Theoretical Chemistry, Faculty of Chemistry, University of Vienna, Währinger Straße 17, A-1090 Vienna, Austria.; Padula D; Dipartimento di Biotecnologie, Chimica e Farmacia, Università di Siena, Via A. Moro 2, 53100 Siena, Italy.; Pandharkar R; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Department of Chemistry, Pritzker School of Molecular Engineering, James Franck Institute, Chicago Center for Theoretical Chemistry, The University of Chicago, Chicago, Illinois 60637, United States.; Phung QM; Department of Chemistry, Graduate School of Science, Nagoya University, Furo-cho, Chikusa-ku, Nagoya, Aichi 464-8602, Japan.; Institute of Transformative Bio-Molecules (WPI-ITbM), Nagoya University, Furo-cho, Chikusa-ku, Nagoya, Aichi 464-8601, Japan.; Plasser F; Department of Chemistry, Loughborough University, Loughborough, LE11 3TU, U.K.; Raggi G; Department of Chemistry - BMC, Uppsala University, P.O. Box 576, SE-75123 Uppsala, Sweden.; Quantum Materials and Software LTD, 128 City Road, London, EC1V 2NX, United Kingdom.; Rebolini E; Scientific Computing Group, Institut Laue Langevin, 38042 Grenoble, France.; Reiher M; ETH Zurich, Laboratory for Physical Chemistry, Vladimir-Prelog-Weg 2, 8093 Zurich, Switzerland.; Rivalta I; Department of Industrial Chemistry 'Toso Montanari', University of Bologna, 40136 Bologna, Italy.; Roca-Sanjuán D; Instituto de Ciencia Molecular, Universitat de València, Catedrático José Beltrán Martínez n. 2, 46980 Paterna, Spain.; Romig T; Institut für Physik, Universität Rostock, Albert-Einstein-Str. 23-24, 18059 Rostock, Germany.; Safari AA; Electronic Structure Theory Department, Max Planck Institute for Solid State Research, Heisenbergstraße 1, 70569 Stuttgart, Germany.; Sánchez-Mansilla A; Department of Physical and Inorganic Chemistry, Universitat Rovira i Virgili, Tarragona 43007, Spain.; Sand AM; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Department of Chemistry and Biochemistry, Butler University, Indianapolis, Indiana 46208, United States.; Schapiro I; Institute of Chemistry, The Hebrew University of Jerusalem, Jerusalem 91904, Israel.; Scott TR; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Department of Chemistry, Pritzker School of Molecular Engineering, James Franck Institute, Chicago Center for Theoretical Chemistry, The University of Chicago, Chicago, Illinois 60637, United States.; Department of Chemistry, University of California, Irvine, California 92697, United States.; Segarra-Martí J; Instituto de Ciencia Molecular, Universitat de València, Catedrático José Beltrán Martínez n. 2, 46980 Paterna, Spain.; Segatta F; Department of Industrial Chemistry 'Toso Montanari', University of Bologna, 40136 Bologna, Italy.; Sergentu DC; Department of Chemistry, University at Buffalo, State University of New York, Buffalo, New York 14260-3000, United States.; Laboratory RA-03, RECENT AIR, A. I. Cuza University of Iaşi, RA-03 Laboratory (RECENT AIR), Iaşi 700506, Romania.; Sharma P; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Shepard R; Chemical Sciences and Engineering Division, Argonne National Laboratory, Lemont, Illinois 60439, USA.; Shu Y; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Staab JK; The Department of Chemistry, The University of Manchester, M13 9PL, Manchester, U.K.; Straatsma TP; National Center for Computational Sciences, Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831-6373, United States.; Department of Chemistry and Biochemistry, University of Alabama, Tuscaloosa, Alabama 35487-0336, United States.; Sørensen LK; University Library, University of Southern Denmark, DK-5230 Odense M, Denmark.; Tenorio BNC; Department of Chemistry, Technical University of Denmark, Kemitorvet Bldg 207, 2800 Kongens Lyngby, Denmark.; Truhlar DG; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Ungur L; Department of Chemistry, National University of Singapore, 3 Science Drive 3, 117543 Singapore.; Vacher M; Nantes Université, CNRS, CEISAM, UMR 6230, F-44000 Nantes, France.; Veryazov V; Division of Theoretical Chemistry, Chemical Centre, Lund University, P.O. Box 124, SE-22100, Lund, Sweden.; Voß TA; Institut für Physik, Universität Rostock, Albert-Einstein-Str. 23-24, 18059 Rostock, Germany.; Weser O; Electronic Structure Theory Department, Max Planck Institute for Solid State Research, Heisenbergstraße 1, 70569 Stuttgart, Germany.; Wu D; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Yang X; Chemistry Department, Bowling Green State University, Overmann Hall, Bowling Green, Ohio 43403, United States.; Yarkony D; Department of Chemistry, Johns Hopkins University, Baltimore, Maryland 21218, United States.; Zhou C; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, United States.; Zobel JP; Institute of Theoretical Chemistry, Faculty of Chemistry, University of Vienna, Währinger Straße 17, A-1090 Vienna, Austria.; Lindh R; Department of Chemistry - BMC, Uppsala University, P.O. Box 576, SE-75123 Uppsala, Sweden.; Uppsala Center for Computational Chemistry (UC3), Uppsala University, PO Box 576, SE-751 23 Uppsala. Sweden.

Publisher: American Chemical Society Country of Publication: United States NLM ID: 101232704 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1549-9626 (Electronic) Linking ISSN: 15499618 NLM ISO Abbreviation: J Chem Theory Comput Subsets: PubMed not MEDLINE; MEDLINE

Veryazov, V. A.; Leko, A. V.; Évarestov, R. A.

Physics of the Solid State. August 1999 41(8):1286-1290

Wei, Y.; Kantorovich, L.; Veryazov, V.

In: APL Materials. (APL Materials, 1 March 2024, 12(3))

Larsson ED; Division of Theoretical Chemistry, Lund University, Lund 22100, Sweden.; Department of Physics, Chemistry and Pharmacy, University of Southern Denmark, Campusvej 55, DK-5230 Odense M, Denmark.; Veryazov V; Division of Theoretical Chemistry, Lund University, Lund 22100, Sweden.

Publisher: American Institute of Physics Country of Publication: United States NLM ID: 0375360 Publication Model: Print Cited Medium: Internet ISSN: 1089-7690 (Electronic) Linking ISSN: 00219606 NLM ISO Abbreviation: J Chem Phys Subsets: PubMed not MEDLINE; MEDLINE

Evarestov, R. A.; Veryazov, V. A.

Theoretica chimica acta. January 1991 81(1-2):95-103

Massó, Helena; Veryazov, V.; Malmqvist, P. A.; Roos, B. O.; Senent, María Luisa

Digital.CSIC. Repositorio Institucional del CSIC
Consejo Superior de Investigaciones Científicas (CSIC)
instname

Schapiro, Igor; Gueye, Moussa; Paolino, Marco; Fusi, Stefania; Marchand, Gabriel; Haacke, Stefan; Martin, M. Elena; Huntress, Mark; Vysotskiy, Victor; Veryazov, Valera; Léonard, Jérémie; Olivucci, Massimo

Photochemical & Photobiological Sciences. 18:2259-2269

Larsson, E.D.; Veryazov, V.; Krośnicki, M.

In: Chemical Physics. (Chemical Physics, 1 October 2022, 562)

Larsson ED; Division of Theoretical Chemistry, Chemical Centre, Lund University, Lund, Sweden.; Veryazov V; Division of Theoretical Chemistry, Chemical Centre, Lund University, Lund, Sweden.

Publisher: Frontiers Media S.A Country of Publication: Switzerland NLM ID: 101627988 Publication Model: eCollection Cited Medium: Print ISSN: 2296-2646 (Print) Linking ISSN: 22962646 NLM ISO Abbreviation: Front Chem Subsets: PubMed not MEDLINE

Zobel JP; Widmark PO; Veryazov V

Publisher: American Chemical Society Country of Publication: United States NLM ID: 101232704 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1549-9626 (Electronic) Linking ISSN: 15499618 NLM ISO Abbreviation: J Chem Theory Comput Subsets: PubMed not MEDLINE; MEDLINE

Aquilante F; Theory and Simulation of Materials (THEOS) and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), École Polytechnique Fédérale de Lausanne (EPFL), CH-1015 Lausanne, Switzerland.; Autschbach J; Department of Chemistry, University at Buffalo, Buffalo, New York 14260-3000, USA.; Baiardi A; Laboratory of Physical Chemistry, ETH Zurich, Vladimir-Prelog-Weg 2, 8093 Zurich, Switzerland.; Battaglia S; Department of Chemistry - BMC, Uppsala University, P.O. Box 576, SE-751 23 Uppsala, Sweden.; Borin VA; Fritz Haber Center for Molecular Dynamics Research, Institute of Chemistry, The Hebrew University of Jerusalem, Jerusalem 9190401, Israel.; Chibotaru LF; Department of Chemistry, KU Leuven, Celestijnenlaan 200F, 3001 Leuven, Belgium.; Conti I; Dipartimento di Chimica Industriale 'Toso Montanari', Università di Bologna, Viale del Risorgimento 4, Bologna I-40136, Italy.; De Vico L; Dipartimento di Biotecnologie, Chimica e Farmacia, Università degli Studi di Siena, via Aldo Moro 2, 53100 Siena, Italy.; Delcey M; Department of Chemistry - Ångström Laboratory, Uppsala University, SE-751 21 Uppsala, Sweden.; Fdez Galván I; Department of Chemistry - BMC, Uppsala University, P.O. Box 576, SE-751 23 Uppsala, Sweden.; Ferré N; Aix-Marseille University, CNRS, Institut Chimie Radicalaire, Marseille, France.; Freitag L; Laboratory of Physical Chemistry, ETH Zurich, Vladimir-Prelog-Weg 2, 8093 Zurich, Switzerland.; Garavelli M; Dipartimento di Chimica Industriale 'Toso Montanari', Università di Bologna, Viale del Risorgimento 4, Bologna I-40136, Italy.; Gong X; Department of Chemistry, University of Singapore, 3 Science Drive 3, 117543 Singapore.; Knecht S; Laboratory of Physical Chemistry, ETH Zurich, Vladimir-Prelog-Weg 2, 8093 Zurich, Switzerland.; Larsson ED; Division of Theoretical Chemistry, Lund University, P.O. Box 124, Lund 22100, Sweden.; Lindh R; Department of Chemistry - BMC, Uppsala University, P.O. Box 576, SE-751 23 Uppsala, Sweden.; Lundberg M; Department of Chemistry - Ångström Laboratory, Uppsala University, SE-751 21 Uppsala, Sweden.; Malmqvist PÅ; Division of Theoretical Chemistry, Lund University, P.O. Box 124, Lund 22100, Sweden.; Nenov A; Dipartimento di Chimica Industriale 'Toso Montanari', Università di Bologna, Viale del Risorgimento 4, Bologna I-40136, Italy.; Norell J; Department of Physics, AlbaNova University Center, Stockholm University, SE-106 91 Stockholm, Sweden.; Odelius M; Department of Physics, AlbaNova University Center, Stockholm University, SE-106 91 Stockholm, Sweden.; Olivucci M; Dipartimento di Biotecnologie, Chimica e Farmacia, Università degli Studi di Siena, via Aldo Moro 2, 53100 Siena, Italy.; Pedersen TB; Hylleraas Centre for Quantum Molecular Sciences, Department of Chemistry, University of Oslo, P.O. Box 1033 Blindern, N-0315 Oslo, Norway.; Pedraza-González L; Dipartimento di Biotecnologie, Chimica e Farmacia, Università degli Studi di Siena, via Aldo Moro 2, 53100 Siena, Italy.; Phung QM; Institute of Transformative Bio-Molecules (WPI-ITbM), Nagoya University, Chikusa, Nagoya 464-8602, Japan.; Pierloot K; Department of Chemistry, KU Leuven, Celestijnenlaan 200F, 3001 Leuven, Belgium.; Reiher M; Laboratory of Physical Chemistry, ETH Zurich, Vladimir-Prelog-Weg 2, 8093 Zurich, Switzerland.; Schapiro I; Fritz Haber Center for Molecular Dynamics Research, Institute of Chemistry, The Hebrew University of Jerusalem, Jerusalem 9190401, Israel.; Segarra-Martí J; Department of Chemistry, Molecular Sciences Research Hub, Imperial College London, White City Campus, 80 Wood Lane, London W12 0BZ, United Kingdom.; Segatta F; Dipartimento di Chimica Industriale 'Toso Montanari', Università di Bologna, Viale del Risorgimento 4, Bologna I-40136, Italy.; Seijo L; Departamento de Química, Instituto Universitario de Ciencia de Materiales Nicolás Cabrera, and Condensed Matter Physics Center (IFIMAC), Universidad Autónoma de Madrid, 28049 Madrid, Spain.; Sen S; Fritz Haber Center for Molecular Dynamics Research, Institute of Chemistry, The Hebrew University of Jerusalem, Jerusalem 9190401, Israel.; Sergentu DC; Department of Chemistry, University at Buffalo, Buffalo, New York 14260-3000, USA.; Stein CJ; Laboratory of Physical Chemistry, ETH Zurich, Vladimir-Prelog-Weg 2, 8093 Zurich, Switzerland.; Ungur L; Department of Chemistry, University of Singapore, 3 Science Drive 3, 117543 Singapore.; Vacher M; Laboratoire CEISAM - UMR CNRS 6230, Université de Nantes, 44300 Nantes, France.; Valentini A; Theoretical Physical Chemistry, Research Unit MolSys, Université de Liège, Allée du 6 Août, 11, 4000 Liège, Belgium.; Veryazov V; Division of Theoretical Chemistry, Lund University, P.O. Box 124, Lund 22100, Sweden.

Publisher: American Institute of Physics Country of Publication: United States NLM ID: 0375360 Publication Model: Print Cited Medium: Internet ISSN: 1089-7690 (Electronic) Linking ISSN: 00219606 NLM ISO Abbreviation: J Chem Phys Subsets: PubMed not MEDLINE; MEDLINE

Larsson ED; Department of Theoretical Chemistry, Lund University, Chemical Centre, P. O. Box 124, SE-221 00 Lund, Sweden. erik.hedegard@teokem.lu.se.; Dong G; Veryazov V; Ryde U; Hedegård ED

Publisher: Royal Society of Chemistry Country of Publication: England NLM ID: 101176026 Publication Model: Print Cited Medium: Internet ISSN: 1477-9234 (Electronic) Linking ISSN: 14779226 NLM ISO Abbreviation: Dalton Trans Subsets: MEDLINE

Zobel JP; Division of Theoretical Chemistry, Kemicentrum , Lund University , P.O. Box 124, SE-221 00 Lund , Sweden.; Widmark PO; Division of Theoretical Chemistry, Kemicentrum , Lund University , P.O. Box 124, SE-221 00 Lund , Sweden.; Veryazov V; Division of Theoretical Chemistry, Kemicentrum , Lund University , P.O. Box 124, SE-221 00 Lund , Sweden.

Publisher: American Chemical Society Country of Publication: United States NLM ID: 101232704 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1549-9626 (Electronic) Linking ISSN: 15499618 NLM ISO Abbreviation: J Chem Theory Comput Subsets: PubMed not MEDLINE; MEDLINE

Fdez Galván I; Department of Chemistry - Ångström Laboratory , Uppsala University , P.O. Box 538, SE-751 21 Uppsala , Sweden.; Department of Chemistry - BMC , Uppsala University , P.O. Box 576, SE-751 23 Uppsala , Sweden.; Vacher M; Department of Chemistry - Ångström Laboratory , Uppsala University , P.O. Box 538, SE-751 21 Uppsala , Sweden.; Alavi A; Max Planck Institut für Festkörperforschung , Heisenbergstraße 1 , 70569 Stuttgart , Germany.; Angeli C; Dipartimento di Scienze Chimiche e Farmaceutiche , Università di Ferrara , Via Luigi Borsari 46 , 44121 Ferrara , Italy.; Aquilante F; Département de Chimie Physique , Université de Genève , 30 quai Ernest-Ansermet , CH-1211 Genève 4 , Switzerland.; Autschbach J; Department of Chemistry , University at Buffalo, State University of New York , Buffalo , New York 14260-3000 , United States.; Bao JJ; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute , University of Minnesota , Minneapolis , Minnesota 55455-0431 , United States.; Bokarev SI; Institut für Physik , Universität Rostock , Albert-Einstein-Straße 23-24 , 18059 Rostock , Germany.; Bogdanov NA; Max Planck Institut für Festkörperforschung , Heisenbergstraße 1 , 70569 Stuttgart , Germany.; Carlson RK; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute , University of Minnesota , Minneapolis , Minnesota 55455-0431 , United States.; Chibotaru LF; Theory of Nanomaterials Group , University of Leuven , Celestijnenlaan 200F , Leuven 3001 , Belgium.; Creutzberg J; Department of Physics, AlbaNova University Center , Stockholm University , SE-106 91 Stockholm , Sweden.; Division of Theoretical Chemistry, Kemicentrum , Lund University , P.O. Box 124, SE-221 00 Lund , Sweden.; Dattani N; Harvard Smithsonian Center for Astrophysics , Cambridge , Massachusetts 02138 , United States.; Delcey MG; Department of Chemistry - Ångström Laboratory , Uppsala University , P.O. Box 538, SE-751 21 Uppsala , Sweden.; Dong SS; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute , University of Minnesota , Minneapolis , Minnesota 55455-0431 , United States.; Dreuw A; Interdisciplinary Center for Scientific Computing , Heidelberg University , Im Neuenheimer Feld 205 A , 69120 Heidelberg , Germany.; Freitag L; Laboratorium für Physikalische Chemie , ETH Zürich , Vladimir-Prelog-Weg 2 , 8093 Zürich , Switzerland.; Frutos LM; Departamento de Química Analítica, Química Física e Ingeniería Química, and Instituto de Investigación Química 'Andrés M. del Río' , Universidad de Alcalá , E-28871 Alcalá de Henares, Madrid , Spain.; Gagliardi L; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute , University of Minnesota , Minneapolis , Minnesota 55455-0431 , United States.; Gendron F; Department of Chemistry , University at Buffalo, State University of New York , Buffalo , New York 14260-3000 , United States.; Giussani A; Department of Chemistry , University College London , 20 Gordon Street , London WC1H 0AJ , United Kingdom.; Instituto de Ciencia Molecular , Universitat de València , Apartado 22085, ES-46071 Valencia , Spain.; González L; Institute of Theoretical Chemistry, Faculty of Chemistry , University of Vienna , Währinger Straße 17 , 1090 Vienna , Austria.; Grell G; Institut für Physik , Universität Rostock , Albert-Einstein-Straße 23-24 , 18059 Rostock , Germany.; Guo M; Department of Chemistry - Ångström Laboratory , Uppsala University , P.O. Box 538, SE-751 21 Uppsala , Sweden.; Hoyer CE; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute , University of Minnesota , Minneapolis , Minnesota 55455-0431 , United States.; Johansson M; Division of Theoretical Chemistry, Kemicentrum , Lund University , P.O. Box 124, SE-221 00 Lund , Sweden.; Keller S; Laboratorium für Physikalische Chemie , ETH Zürich , Vladimir-Prelog-Weg 2 , 8093 Zürich , Switzerland.; Knecht S; Laboratorium für Physikalische Chemie , ETH Zürich , Vladimir-Prelog-Weg 2 , 8093 Zürich , Switzerland.; Kovačević G; Division of Materials Physics , Ruđer Bošković Institute , P.O.B. 180, Bijenička 54 , HR-10002 Zagreb , Croatia.; Källman E; Department of Chemistry - Ångström Laboratory , Uppsala University , P.O. Box 538, SE-751 21 Uppsala , Sweden.; Li Manni G; Max Planck Institut für Festkörperforschung , Heisenbergstraße 1 , 70569 Stuttgart , Germany.; Lundberg M; Department of Chemistry - Ångström Laboratory , Uppsala University , P.O. Box 538, SE-751 21 Uppsala , Sweden.; Ma Y; Laboratorium für Physikalische Chemie , ETH Zürich , Vladimir-Prelog-Weg 2 , 8093 Zürich , Switzerland.; Mai S; Institute of Theoretical Chemistry, Faculty of Chemistry , University of Vienna , Währinger Straße 17 , 1090 Vienna , Austria.; Malhado JP; Department of Chemistry , Imperial College London , London SW7 2AZ , United Kingdom.; Malmqvist PÅ; Division of Theoretical Chemistry, Kemicentrum , Lund University , P.O. Box 124, SE-221 00 Lund , Sweden.; Marquetand P; Institute of Theoretical Chemistry, Faculty of Chemistry , University of Vienna , Währinger Straße 17 , 1090 Vienna , Austria.; Mewes SA; Interdisciplinary Center for Scientific Computing , Heidelberg University , Im Neuenheimer Feld 205 A , 69120 Heidelberg , Germany.; Centre for Theoretical Chemistry and Physics, The New Zealand Institute for Advanced Study (NZIAS) , Massey University Albany , Private Bag 102904, Auckland 0632 , New Zealand.; Norell J; Department of Physics, AlbaNova University Center , Stockholm University , SE-106 91 Stockholm , Sweden.; Olivucci M; Department of Biotechnology, Chemistry and Pharmacy , University of Siena , via A. Moro 2 , 53100 Siena , Italy.; Department of Chemistry , Bowling Green State University , Bowling Green , Ohio 43403 , United States.; USIAS and Institut de Physique et Chimie des Matériaux de Strasbourg , Université de Strasbourg-CNRS , 67034 Strasbourg , France.; Oppel M; Institute of Theoretical Chemistry, Faculty of Chemistry , University of Vienna , Währinger Straße 17 , 1090 Vienna , Austria.; Phung QM; Department of Chemistry , KU Leuven , Celestijnenlaan 200F , Leuven 3001 , Belgium.; Pierloot K; Department of Chemistry , KU Leuven , Celestijnenlaan 200F , Leuven 3001 , Belgium.; Plasser F; Department of Chemistry , Loughborough University , Loughborough LE11 3TU , United Kingdom.; Reiher M; Laboratorium für Physikalische Chemie , ETH Zürich , Vladimir-Prelog-Weg 2 , 8093 Zürich , Switzerland.; Sand AM; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute , University of Minnesota , Minneapolis , Minnesota 55455-0431 , United States.; Schapiro I; Institute of Chemistry , The Hebrew University of Jerusalem , Jerusalem , Israel.; Sharma P; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute , University of Minnesota , Minneapolis , Minnesota 55455-0431 , United States.; Stein CJ; Laboratorium für Physikalische Chemie , ETH Zürich , Vladimir-Prelog-Weg 2 , 8093 Zürich , Switzerland.; Sørensen LK; Department of Chemistry - Ångström Laboratory , Uppsala University , P.O. Box 538, SE-751 21 Uppsala , Sweden.; Truhlar DG; Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute , University of Minnesota , Minneapolis , Minnesota 55455-0431 , United States.; Ugandi M; Department of Chemistry - Ångström Laboratory , Uppsala University , P.O. Box 538, SE-751 21 Uppsala , Sweden.; Ungur L; Department of Chemistry , National University of Singapore , 117543 Singapore.; Valentini A; Theoretical Physical Chemistry , Research Unit MolSys , Allée du 6 Août, 11 , 4000 Liège , Belgium.; Vancoillie S; Division of Theoretical Chemistry, Kemicentrum , Lund University , P.O. Box 124, SE-221 00 Lund , Sweden.; Veryazov V; Division of Theoretical Chemistry, Kemicentrum , Lund University , P.O. Box 124, SE-221 00 Lund , Sweden.; Weser O; Max Planck Institut für Festkörperforschung , Heisenbergstraße 1 , 70569 Stuttgart , Germany.; Wesołowski TA; Département de Chimie Physique , Université de Genève , 30 quai Ernest-Ansermet , CH-1211 Genève 4 , Switzerland.; Widmark PO; Division of Theoretical Chemistry, Kemicentrum , Lund University , P.O. Box 124, SE-221 00 Lund , Sweden.; Wouters S; Brantsandpatents , Pauline van Pottelsberghelaan 24 , 9051 Sint-Denijs-Westrem , Belgium.; Zech A; Département de Chimie Physique , Université de Genève , 30 quai Ernest-Ansermet , CH-1211 Genève 4 , Switzerland.; Zobel JP; Division of Theoretical Chemistry, Kemicentrum , Lund University , P.O. Box 124, SE-221 00 Lund , Sweden.; Lindh R; Department of Chemistry - BMC , Uppsala University , P.O. Box 576, SE-751 23 Uppsala , Sweden.; Uppsala Center for Computational Chemistry (UC3) , Uppsala University , P.O. Box 596, SE-751 24 Uppsala , Sweden.

Publisher: American Chemical Society Country of Publication: United States NLM ID: 101232704 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1549-9626 (Electronic) Linking ISSN: 15499618 NLM ISO Abbreviation: J Chem Theory Comput Subsets: PubMed not MEDLINE; MEDLINE