A
Anders Osted
Researcher at University of Copenhagen
Publications - 25
Citations - 2610
Anders Osted is an academic researcher from University of Copenhagen. The author has contributed to research in topics: Coupled cluster & Polarizability. The author has an hindex of 18, co-authored 25 publications receiving 2371 citations.
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Journal ArticleDOI
The Dalton quantum chemistry program system
Kestutis Aidas,Celestino Angeli,Keld L. Bak,Vebjørn Bakken,Radovan Bast,Linus Boman,Ove Christiansen,Renzo Cimiraglia,Sonja Coriani,Pål Dahle,Erik K. Dalskov,Ulf Ekström,Thomas Enevoldsen,Janus J. Eriksen,Patrick Ettenhuber,Berta Fernández,Lara Ferrighi,Heike Fliegl,Luca Frediani,Kasper Hald,Asger Halkier,Christof Hättig,Hanne Heiberg,Trygve Helgaker,Alf C. Hennum,Hinne Hettema,Eirik Hjertenæs,Stine Høst,Ida-Marie Høyvik,Maria Francesca Iozzi,Brannislav Jansik,Hans-Jørgen Aa. Jensen,Dan Jonsson,Poul Jørgensen,Johanna Kauczor,Sheela Kirpekar,Thomas Kjærgaard,Wim Klopper,Stefan Knecht,Rika Kobayashi,Henrik Koch,Jacob Kongsted,Andreas Krapp,Kasper Kristensen,Andrea Ligabue,Ola B. Lutnæs,Juan Ignacio Melo,Kurt V. Mikkelsen,Rolf H. Myhre,Christian Neiss,Christian B. Nielsen,Patrick Norman,Jeppe Olsen,Jógvan Magnus Haugaard Olsen,Anders Osted,Martin J. Packer,Filip Pawłowski,Thomas Bondo Pedersen,Patricio Federico Provasi,Simen Reine,Zilvinas Rinkevicius,Torgeir A. Ruden,Kenneth Ruud,Vladimir V. Rybkin,Paweł Sałek,Claire C. M. Samson,Alfredo Sánchez de Merás,Trond Saue,Stephan P. A. Sauer,Bernd Schimmelpfennig,Kristian Sneskov,Arnfinn Hykkerud Steindal,Kristian O. Sylvester-Hvid,Peter R. Taylor,Andrew M. Teale,Erik I. Tellgren,David P. Tew,Andreas J. Thorvaldsen,Lea Thøgersen,Olav Vahtras,Mark A. Watson,David J. D. Wilson,Marcin Ziółkowski,Hans Ågren +83 more
TL;DR: Dalton is a powerful general‐purpose program system for the study of molecular electronic structure at the Hartree–Fock, Kohn–Sham, multiconfigurational self‐consistent‐field, Møller–Plesset, configuration‐interaction, and coupled‐cluster levels of theory.
Journal ArticleDOI
Polarizability of molecular clusters as calculated by a dipole interaction model
Lasse Jensen,Per-Olof Åstrand,Per-Olof Åstrand,Anders Osted,Jacob Kongsted,Kurt V. Mikkelsen +5 more
TL;DR: In this article, a dipole interaction model for calculating the polarizability of molecular clusters is proposed, where a damping of the interatomic interaction at short distances is introduced in such a way as to retain a traceless interaction tensor and a good description of the damping over a wide range of interatomic distances.
Dalton, a molecular electronic structure program, Release Dalton2011
Celestino Angeli,Keld L. Bak,Vebjørn Bakken,Ove Christiansen,Renzo Cimiraglia,Sonia Coriani,Pål Dahle,E. K. Dalskov,Thomas Enevoldsen,Berta Fernández,Lara Ferrighi,Luca Frediani,C. Haettig,Kasper Hald,Asger Halkier,H. Heiberg,Trygve Helgaker,Hinne Hettema,B. Jansik,Hans-Jørgen Aa. Jensen,D. Jonsson,Poul Jørgensen,Sheela Kirpekar,Wim Klopper,Stefan Knecht,Rika Kobayashi,Jacob Kongsted,Henrik Koch,Andrea Ligabue,Ola B. Lutnæs,Kurt V. Mikkelsen,Christian B. Nielsen,Patrick Norman,Jeppe Olsen,Anders Osted,Martin J. Packer,Thomas Bondo Pedersen,Zilvinas Rinkevicius,Elias Rudberg,Torgeir A. Ruden,Kenneth Ruud,Paweł Sałek,Claire C. M. Samson,A. M. J. Sanchez de Meras,Trond Saue,Stephan P. A. Sauer,Bernd Schimmelpfennig,Arnfinn Hykkerud Steindal,K. O. Sylvester Hvid,Peter R. Taylor,Olav Vahtras,D. J. Wilson,H. Aagren +52 more
Journal ArticleDOI
The QM/MM approach for wavefunctions, energies and response functions within self-consistent field and coupled cluster theories
TL;DR: In this article, a coupled cluster/molecular mechanics (CC/MM) and self-consistent field-based MCF/MM approaches for wavefunctions, energies and response properties are presented.
Journal ArticleDOI
Linear response functions for coupled cluster/molecular mechanics including polarization interactions
TL;DR: In this article, the authors present the first implementation of linear response theory for the coupled cluster/molecular mechanics (CC/MM) method using a self-consistent procedure while electrostatic effects are modeled by assigning partial charges to the MM molecules and a van der Waals potential describes dispersion and short range repulsion.