Institution · Swedish e-Science Research Centre
Most cited papers from Swedish e-Science Research Centre
What are the most cited papers from Swedish e-Science Research Centre?
The most cited paper from Swedish e-Science Research Centre is "A complete active space SCF method (CASSCF) using a density matrix formulated super-CI approach" (Björn Olof Roos, Peter R. Taylor, Per E.M. Sigbahn, 1980), with 4,040 citations. Next come "Second-order perturbation theory with a complete active space self-consistent field reference function" (3,933) and "The role of artificial intelligence in achieving the Sustainable Development Goals" (3,211).
Showing 50 of 58 papers. Every paper with more than 200 citations is listed.
| # | Paper | ||
|---|---|---|---|
| 1 | A complete active space SCF method (CASSCF) using a density matrix formulated super-CI approach Björn Olof Roos, Peter R. Taylor, Per E.M. Sigbahn · Chemical Physics | May 1980 | 4,040 |
| 2 | Second-order perturbation theory with a complete active space self-consistent field reference function Kerstin Andersson, Per‐Åke Malmqvist, Björn Olof Roos · The Journal of Chemical Physics | 15 Jan 1992 | 3,933 |
| 3 | The role of artificial intelligence in achieving the Sustainable Development Goals Ricardo Vinuesa, Hossein Azizpour, Iolanda Leite et al. · Nature Communications | 13 Jan 2020 | 3,211 |
| 4 | Recognizing human actions: a local SVM approach Christian Schüldt, Ivan Laptev, Barbara Caputo · Proceedings of the 17th International Conference on Pattern Recognition, 2004. ICPR 2004. | 2004 | 3,011 |
| 5 | Density matrix averaged atomic natural orbital (ANO) basis sets for correlated molecular wave functions Per‐Olof Widmark, Per-�ke Malmqvist, Bj�rn O. Roos · Theoretical Chemistry Accounts | 1990 | 1,998 |
| 6 | The multi-state CASPT2 method James P. Finley, Per‐Åke Malmqvist, Björn Olof Roos et al. · Chemical Physics Letters | May 1998 | 1,568 |
| 7 | The D alton quantum chemistry program system Kęstutis Aidas et al. · Wiley Interdisciplinary Reviews Computational Molecular Science | 23 Sep 2013 | 1,523 |
| 8 | The complete active space SCF (CASSCF) method in a Newton–Raphson formulation with application to the HNO molecule Per E. M. Siegbahn, Jan Almløf, Anders Heiberg et al. · The Journal of Chemical Physics | 15 Feb 1981 | 1,232 |
| 9 | New Relativistic ANO Basis Sets for Transition Metal Atoms Björn Olof Roos, Roland H. Lindh, Per‐Åke Malmqvist et al. · The Journal of Physical Chemistry A | Jul 2005 | 1,116 |
| 10 | The CASSCF state interaction method Per‐Åke Malmqvist, Björn Olof Roos · Chemical Physics Letters | Feb 1989 | 1,052 |
| 11 | Heterogeneous parallelization and acceleration of molecular dynamics simulations in GROMACS Szilárd Páll, Artem Zhmurov, Paul Bauer et al. · The Journal of Chemical Physics | 5 Oct 2020 | 962 |
| 12 | Assessment of direct numerical simulation data of turbulent boundary layers Philipp Schlatter, Ramis Örlü · Journal of Fluid Mechanics | 16 Jul 2010 | 955 |
| 13 | Multiconfiguration perturbation theory with imaginary level shift Niclas Forsberg, Per‐Åke Malmqvist · Chemical Physics Letters | Aug 1997 | 885 |
| 14 | A Comparison of the Super-CI and the Newton-Raphson Scheme in the Complete Active Space SCF Method Per Siegbahn, Anders Heiberg, Björn Olof Roos et al. · Physica Scripta | 1980 | 764 |
| 15 | Multiconfigurational perturbation theory with level shift — the Cr2 potential revisited Björn Olof Roos, Kerstin Andersson · Chemical Physics Letters | Oct 1995 | 678 |
| 16 | Enhancing computational fluid dynamics with machine learning Ricardo Vinuesa, Steven L. Brunton · Nature Computational Science | 27 Jun 2022 | 586 |
| 17 | Metal-binding proteins and peptides in bioremediation and phytoremediation of heavy metals Malin Mejàre, Leif Bülow · Trends in biotechnology | Feb 2001 | 540 |
| 18 | Density matrix averaged atomic natural orbital (ANO) basis sets for correlated molecular wave functions Kristine Pierloot, Birgit Dumez, Per‐Olof Widmark et al. · Theoretical Chemistry Accounts | 1995 | 535 |
| 19 | DockQ: A Quality Measure for Protein-Protein Docking Models Sankar Basu, Björn Wallner · PLoS ONE | 25 Aug 2016 | 524 |
| 20 | Halogen bonding in solution Máté Erdélyi · Chemical Society Reviews | 2012 | 516 |
| 21 | A molecular dynamics simulation of a water model with intramolecular degrees of freedom Olle Teleman, Bo Jönsson, Sven Engström · Molecular Physics | 1987 | 451 |
| 22 | Can the atmospheric kinetic energy spectrum be explained by two-dimensional turbulence? Erik Lindborg · Journal of Fluid Mechanics | 10 Jun 1999 | 430 |
| 23 | A molecular dynamics study of polarizable water Peter Ahlström, Anders Wallqvist, Sven Engström et al. · Molecular Physics | 20 Oct 1989 | 414 |
| 24 | Towards an accurate molecular orbital theory for excited states: Ethene, butadiene, and hexatriene Luis Serrano‐Andrés, Manuela Merchán, Ignacio Nebot‐Gil et al. · The Journal of Chemical Physics | 15 Feb 1993 | 411 |
| 25 | Cyclic, pseudocyclic and noncyclic photophosphorylation: new links in the chain John Frederick Allen · Trends in Plant Science | 2003 | 399 |
| 26 | Scaling analysis and simulation of strongly stratified turbulent flows Geert Brethouwer, Paul Billant, Erik Lindborg et al. · Journal of Fluid Mechanics | 7 Aug 2007 | 368 |
| 27 | Direct Numerical Simulation of Turbulent Pipe Flow at Moderately High Reynolds Numbers George K. El Khoury, Philipp Schlatter, Azad Noorani et al. · Flow Turbulence and Combustion | 9 Jul 2013 | 343 |
| 28 | Resistive graphene humidity sensors with rapid and direct electrical readout Anderson D. Smith, Karim Elgammal, Frank Niklaus et al. · Nanoscale | 2015 | 335 |
| 29 | The complete active space SCF method in a fock-matrix-based super-CI formulation Björn Olof Roos · International Journal of Quantum Chemistry | 19 Jun 2009 | 332 |
| 30 | Improving stress tolerance in plants by gene transfer Niklas Holmberg, Leif Bülow · Trends in Plant Science | Feb 1998 | 322 |
| 31 | Koopman-mode decomposition of the cylinder wake Shervin Bagheri · Journal of Fluid Mechanics | 11 Jun 2013 | 319 |
| 32 | Ligand-Binding Affinity Estimates Supported by Quantum-Mechanical Methods Ulf Ryde, Pär Söderhjelm · Chemical Reviews | 14 Apr 2016 | 311 |
| 33 | Hand gesture recognition using multi-scale colour features, hierarchical models and particle filtering Lars Bretzner, Ivan Laptev, Tony Lindeberg | 25 Jun 2003 | 308 |
| 34 | The cell model for polyelectrolyte systems. Exact statistical mechanical relations, Monte Carlo simulations, and the Poisson–Boltzmann approximation Håkan Wennerström, Bo Jönsson, Per Linse · The Journal of Chemical Physics | May 1982 | 302 |
| 35 | A simple method for the evaluation of the second-order-perturbation energy from external double-excitations with a CASSCF reference wavefunction Björn Olof Roos, Per Linse, Per E. M. Siegbahn et al. · Chemical Physics | Apr 1982 | 300 |
| 36 | Density matrix averaged atomic natural orbital (ANO) basis sets for correlated molecular wave functions Rosendo Pou‐Amérigo, Manuela Merchán, Ignacio Nebot‐Gil et al. · Theoretical Chemistry Accounts | Sep 1995 | 289 |
| 37 | Turbulent boundary layers at moderate Reynolds numbers: inflow length and tripping effects Philipp Schlatter, Ramis Örlü · Journal of Fluid Mechanics | 21 Aug 2012 | 289 |
| 38 | Flow structures around a high-speed train extracted using Proper Orthogonal Decomposition and Dynamic Mode Decomposition Tomas W. Muld, Gunilla Efraimsson, Dan S. Henningson · Computers & Fluids | 4 Jan 2012 | 287 |
| 39 | Predictions of turbulent shear flows using deep neural networks Prem A. Srinivasan, Luca Guastoni, Hossein Azizpour et al. · Physical Review Fluids | 10 May 2019 | 280 |
| 40 | Turbulent channel flow of dense suspensions of neutrally buoyant spheres Francesco Picano, Wim-Paul Breugem, Luca Brandt · Journal of Fluid Mechanics | 8 Jan 2015 | 280 |
| 41 | Turbulent boundary layers up to Reθ=2500 studied through simulation and experiment Philipp Schlatter, Ramis Örlü, Qiushi Li et al. · Physics of Fluids | May 2009 | 277 |
| 42 | Extraction, fractionation and characterization of proteoglycans from bovine tracheal cartilage Dick K. Heinegård · Biochimica et Biophysica Acta (BBA) - Protein Structure | Nov 1972 | 276 |
| 43 | Quasi-potential landscape in complex multi-stable systems Joseph Zhou, M. D. S. Aliyu, Erik M. Aurell et al. · Journal of The Royal Society Interface | 29 Aug 2012 | 261 |
| 44 | π-Extended perylene diimide double-heterohelicenes as ambipolar organic semiconductors for broadband circularly polarized light detection Li Zhang, Inho Song, Jaeyong Ahn et al. · Nature Communications | 8 Jan 2021 | 251 |
| 45 | Simulation of wind turbine wakes using the actuator line technique Jens Nørkær Sørensen, Robert Mikkelsen, Dan S. Henningson et al. · Philosophical Transactions of the Royal Society A Mathematical Physical and Engineering Sciences | 12 Jan 2015 | 241 |
| 46 | Multiconfigurational second‐order perturbation theory: A test of geometries and binding energies Kerstin Andersson, Björn Olof Roos · International Journal of Quantum Chemistry | 1993 | 237 |
| 47 | Immobilization of enzymes and affinity ligands to various hydroxyl group carrying supports using highly reactive sulfonyl chlorides KURT G. I. NILSSON, Klaus Mosbach · Biochemical and Biophysical Research Communications | Sep 1981 | 233 |
| 48 | Persistence of various types of innovation analyzed and explained Sam Tavassoli, Charlie Karlsson · Research Policy | 13 Aug 2015 | 225 |
| 49 | Towards an accurate molecular orbital theory for excited states: the benzene molecule Björn Olof Roos, Kerstin Andersson, Markus P. Fülscher · Chemical Physics Letters | Apr 1992 | 224 |
| 50 | The sharp-interface limit of the Cahn–Hilliard/Navier–Stokes model for binary fluids Francesco Magaletti, Francesco Picano, Mauro Chinappi et al. · Journal of Fluid Mechanics | 2 Jan 2013 | 223 |
Citations are OpenAlex's own counts, from its 2026-09-23 snapshot, so the ranking can differ from Google Scholar or Web of Science. A paper is listed for an institution when any of its authors gave it as an affiliation; retracted papers and papers whose citation count cannot be traced to citing works are left out, and a preprint and the article it became are shown once. Release dates are OpenAlex's: where a source gave only a month or a year, that is what is shown. How the lists are chosen.