Roland Lindh

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Per Åke MalmqvistAssociate Professor, Lund UniversityAdresse e-mail validée de teokem.lu.se
Francesco AquilanteEPFL - École Polytechnique Fédérale de LausanneAdresse e-mail validée de epfl.ch
Thomas Bondo PedersenHylleraas Centre for Quantum Molecular Sciences, Dept. of Chemistry, University of OsloAdresse e-mail validée de kjemi.uio.no
Valera VeryazovLund UniversityAdresse e-mail validée de teokem.lu.se
Daniel Roca-SanjuánInvestigador ContratadoAdresse e-mail validée de uv.es
Nicolas FerréAix-Marseille UniversitéAdresse e-mail validée de univ-amu.fr
Isabelle NavizetUniv Gustave EiffelAdresse e-mail validée de univ-eiffel.fr
Martin SchützProfessor of Theoretical Chemistry, University of RegensburgAdresse e-mail validée de chemie.uni-regensburg.de
Mickael G. DelceyResearcher in theoretical chemistry, Lund UniversityAdresse e-mail validée de teokem.lu.se
Markus ReiherProfessor of Theoretical Chemistry, ETH ZurichAdresse e-mail validée de phys.chem.ethz.ch
Luca De VicoSiena UniversityAdresse e-mail validée de unisi.it
Jeppe OlsenAdresse e-mail validée de chem.au.dk
Luis SeijoUniversidad Autónoma de MadridAdresse e-mail validée de uam.es
MASSIMO OLIVUCCIUniversity of Siena and Bowling Green State UniversityAdresse e-mail validée de unisi.it
Marcus LundbergDepartment of Chemistry - Ångström Laboratory, Uppsala UniversityAdresse e-mail validée de kemi.uu.se
Morgane VacherUniversité de Nantes - CNRSAdresse e-mail validée de univ-nantes.fr
Ulf RydeProfessor in Theoretical Chemistry, Lund UniversityAdresse e-mail validée de teokem.lu.se
Leticia GonzálezUniversity of Vienna, Faculty of Chemistry, Professor for Theoretical ChemistryAdresse e-mail validée de univie.ac.at
Lasse Kragh SørensenUppsala universityAdresse e-mail validée de kemi.uu.se
Luis Manuel FrutosUniversity of Alcala (Physical Chemistry)Adresse e-mail validée de uah.es

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Roland Lindh

Professor in Theoretical Chemistry, Uppsala University, Sweden

Adresse e-mail validée de kemi.uu.se - Page d'accueil

Ab Initio methods bioluminescence chemiluminescence chemiexcitations


Titre Trier par citations Trier par année Trier par titre	Citée par Citée par	Année
MOLCAS: a program package for computational chemistry G Karlström, R Lindh, PÅ Malmqvist, BO Roos, U Ryde, V Veryazov, ... Computational Materials Science 28 (2), 222-239, 2003	1909	2003
MOLCAS 7: the next generation F Aquilante, L De Vico, N Ferré, G Ghigo, P Malmqvist, P Neogrády, ... Journal of computational chemistry 31 (1), 224-247, 2010	1741	2010
Main group atoms and dimers studied with a new relativistic ANO basis set BO Roos, R Lindh, PÅ Malmqvist, V Veryazov, PO Widmark The Journal of Physical Chemistry A 108 (15), 2851-2858, 2004	1630	2004
Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table F Aquilante, J Autschbach, RK Carlson, LF Chibotaru, MG Delcey, ... Journal of computational chemistry 37 (5), 506-541, 2016	1612	2016
New relativistic ANO basis sets for transition metal atoms BO Roos, R Lindh, PÅ Malmqvist, V Veryazov, PO Widmark The Journal of Physical Chemistry A 109 (29), 6575-6579, 2005	1176	2005
OpenMolcas: From source code to insight I Fdez. Galván, M Vacher, A Alavi, C Angeli, F Aquilante, J Autschbach, ... Journal of chemical theory and computation 15 (11), 5925-5964, 2019	821	2019
MOLPRO, version 2010.1, a package of ab initio programs HJ Werner, PJ Knowles, G Knizia, FR Manby, M Schütz, P Celani, ... See http://www. molpro. net, 2010	633*	2010
Towards an accurate molecular orbital theory for excited states: Ethene, butadiene, and hexatriene L Serrano‐Andrés, M Merchán, I Nebot‐Gil, R Lindh, BO Roos The Journal of chemical physics 98 (4), 3151-3162, 1993	522	1993
MOLCAS Version 5.4 K Andersson, M Barysz, A Bernhardsson, MRA Blomberg, DL Cooper, ... Lund University, Sweden 23, 2002	493	2002
New Relativistic Atomic Natural Orbital Basis Sets for Lanthanide Atoms with Applications to the Ce Diatom and LuF₃ BO Roos, R Lindh, PÅ Malmqvist, V Veryazov, PO Widmark, AC Borin The Journal of Physical Chemistry A 112 (45), 11431-11435, 2008	482	2008
MOLPRO, version 2012.1, a package of ab initio programs HJ Werner, PJ Knowles, G Knizia, FR Manby, M Schütz, P Celani, ... See http://www. molpro. net, 2012	416	2012
Modern quantum chemistry with [Open] Molcas F Aquilante, J Autschbach, A Baiardi, S Battaglia, VA Borin, LF Chibotaru, ... The Journal of chemical physics 152 (21), 2020	410	2020
Local properties of quantum chemical systems: The LoProp approach L Gagliardi, R Lindh, G Karlström The Journal of chemical physics 121 (10), 4494-4500, 2004	400	2004
2MOLCAS as a development platform for quantum chemistry software V Veryazov, PO Widmark, L Serrano‐Andrés, R Lindh, BO Roos International journal of quantum chemistry 100 (4), 626-635, 2004	369	2004
MOLPRO, version 2015.1, a package of ab initio programs HJ Werner, PJ Knowles, G Knizia, FR Manby, M Schütz, P Celani, ... University of Cardiff Chemistry Consultants (UC3): Cardiff, Wales, UK, 2015	363	2015
Low-cost evaluation of the exchange Fock matrix from Cholesky and density fitting representations of the electron repulsion integrals F Aquilante, TB Pedersen, R Lindh The Journal of chemical physics 126 (19), 2007	357	2007
Unbiased auxiliary basis sets for accurate two-electron integral approximations F Aquilante, R Lindh, T Bondo Pedersen The Journal of chemical physics 127 (11), 2007	353	2007
Chemi-and bioluminescence of cyclic peroxides M Vacher, I Fdez. Galván, BW Ding, S Schramm, R Berraud-Pache, ... Chemical reviews 118 (15), 6927-6974, 2018	333	2018
The reduced multiplication scheme of the Rys quadrature and new recurrence relations for auxiliary function based two‐electron integral evaluation R Lindh, U Ryu, B Liu The Journal of chemical physics 95 (8), 5889-5897, 1991	333	1991
New relativistic ANO basis sets for actinide atoms BO Roos, R Lindh, PÅ Malmqvist, V Veryazov, PO Widmark Chemical physics letters 409 (4-6), 295-299, 2005	316	2005

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