Publications

This is an overview of the scientific articles and books published by the Hylleraas-researchers.

 

 

Publications

  • Walter Aeschimann; Stephan Kammer; Stefanie Staats; Petra Schneider; Gisbert Schneider; Gerald Rimbach; Michele Cascella & Achim Stocker (2021). Engineering of a functional γ-tocopherol transfer protein. Redox Biology.  ISSN 2213-2317.  38
  • Torsha Moitra; Pijush Karak; Sayantani Chakraborty; Kenneth Ruud & Swapan Chakrabarti (2021). Behind the scenes of spin-forbidden decay pathways in transition metal complexes. Physical Chemistry, Chemical Physics - PCCP.  ISSN 1463-9076.  23, s 59- 81
  • Marc Obst; Ashot Gevorgyan; Annette Bayer & Kathrin Helen Hopmann (2020). Mechanistic Insights into Copper-Catalyzed Carboxylations. Organometallics.  ISSN 0276-7333.  39, s 1545- 1552
  • Peter Reinholdt; Erik Rosendahl Kjellgren; Casper Steinmann & Jógvan Magnus Haugaard Olsen (2020). Cost-Effective Potential for Accurate Polarizable Embedding Calculations in Protein Environments. Journal of Chemical Theory and Computation.  ISSN 1549-9618.
  • Lluís Artús Suàrez; Upul Jayarathne; David Balcells; Wesley H. Bernskoetter; Nilay Hazari; Martin Jaraiz & Ainara Nova (2020). Rational selection of co-catalysts for the deaminative hydrogenation of amides. Chemical Science.  ISSN 2041-6520.  11, s 2225- 2230
  • Håkon Emil Kristiansen; Øyvind Sigmundson Schøyen; Simen Kvaal & Thomas Bondo Pedersen (2020). Numerical stability of time-dependent coupled-cluster methods for many-electron dynamics in intense laser pulses. Journal of Chemical Physics.  ISSN 0021-9606.  152
  • Audun Skau Hansen; Gustav Baardsen; Elisa Rebolini; Lorenzo Maschio & Thomas Bondo Pedersen (2020). Representation of the virtual space in extended systems – a correlation energy convergence study. Molecular Physics.  ISSN 0026-8976.

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  • Abril C Castro & Marcel Swart (2020). Chapter 2. Recent Advances in Computational NMR Spectrum Prediction. Part of Computational Techniques for Analytical Chemistry and Bioanalysis. Royal Society of Chemistry (RSC) Publishing.  ISBN 9781788014618.  28 s.
  • Heike Fliegl; Rashid R. Valiev; Fabio Pichierri & Dage Sundholm (2018). Theoretical studies as a tool for understanding the aromatic character of porphyrinoid compounds. Royal Society of Chemistry.  ISBN 978-1-78801-004-7.  42 s.
  • Radovan Bast & Roberto Di Remigio (2018). CMake Cookbook. Packt Publishing.  ISBN 9781788470711.  506 s.
  • Patrick Norman; Kenneth Ruud & Trond Saue (2018). Principles and Practices of Molecular Properties: Theory, Modeling, and Simulations. John Wiley & Sons.  ISBN 978-0-470-72562-7.  480 s.

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  • Thomas Bondo Pedersen (2020). Laser-Driven Many-Electron Dynamics with Coupled-Cluster Theory.
  • Marius Kadek; Marc Joosten; Michal Repisky & Kenneth Ruud (2020). Four-component Dirac-Kohn-Sham theory for relativistic band structures of periodic systems based on Gaussian-type orbitals.
  • Kenneth Ruud (2020). From real-time method to (quasi)-energy derivatives: Theory and examples of molecular property calculations.
  • Ainara Nova (2020). Hydrogenation of CO2 to methanol by PtNP@UiO67.
  •  (2020). OpenRSP Version v.1.0.0.
  • Geir Villy Isaksen (2019). Point charges..
  • Roberto Di Remigio (2019). Reusable Components for Quantum Chemistry Software.
  • Lluís Artús Suàrez (2019). Microkinetic modelling of CO2 reduction.
  • Lluís Artús Suàrez (2019). Workshop for COPASI microkinetic modelling.
  • Trygve Helgaker (2019). Centre for Data Science and Computational Science.
  • Trygve Helgaker (2019). Hylleraas Centre for Quantum Molecular Sciences: Applying for and Setting up a Centre of Excellence.
  • Trygve Helgaker (2019). Hylleraas Centre for Quantum Molecular Sciences.
  • Ainara Nova (2019). Can we transform carbon dioxide into something useful?.
  • Kenneth Ruud (2019). Relativt god kjemi.
  • Trygve Helgaker (2019). Kvantemekanikk og kjemi.
  • Trygve Helgaker (2019). Kvantemekanikk og kjemi.
  • Trygve Helgaker (2019). Kvantemekanikk og kjemi.
  • Trygve Helgaker (2019). Utenomjordisk kjemi.
  • Trygve Helgaker (2019). Egil A. Hylleraas – en norsk pioner innen kvantemekanikk.
  • Trygve Helgaker (2019). Utenomjordisk kjemi.
  • Trygve Helgaker (2019). Kvantekjemi — på liv og død.
  • Odile Eisenstein (2019). Art and Chemistry, Chemistry and Art.
  • Marius Kadek; Michal Repisky & Kenneth Ruud (2019). All-electron relativistic four-component Dirac-Kohn-Sham theory for solids using Gaussian-type functions.
  • Lluís Artús Suàrez; David Balcells & Ainara Nova (2019). Rational Cocatalyst Design for Amide Hydrogenolysis Based on DFT Calculations.
  • Lukas Konecny; Marius Kadek; Mehboob Alam; Kenneth Ruud & Michal Repisky (2019). Calculation of Molecular Properties Using Relativistic Real-Time TDDFT.
  • Karen Oda Hjorth Dundas (2019). Computational protocol for calculation of IR and Raman spectra for solvated systems.
  • Julie Denise Josette Héron & David Balcells (2019). Catalyst Activation Mechanisms in the Cu2AAC reaction.
  • Karolina Solheimslid Eikås; Kenneth Ruud; Maarten Beerepoot & Bjørn Olav Brandsdal (2019). Towards a computational protocol for VCD spectra of cyclic peptides.
  • Karolina Solheimslid Eikås; Kenneth Ruud; Maarten Beerepoot & Bjørn Olav Brandsdal (2019). Towards a computational protocol for VCD spectra of cyclic peptides.
  • Karolina Solheimslid Eikås; Kenneth Ruud; Maarten Beerepoot & Bjørn Olav Brandsdal (2019). Towards a computational protocol for VCD spectra of cyclic peptides.
  • Karolina Solheimslid Eikås; Kenneth Ruud; Maarten Beerepoot & Bjørn Olav Brandsdal (2019). Towards a computational protocol for VCD spectra of cyclic peptides.
  • Marius Kadek; Michal Repisky & Kenneth Ruud (2019). Full-potential relativistic four-component Dirac-Kohn-Sham method for periodic systems using Gaussian-type functions.
  • Marius Kadek; Michal Repisky & Kenneth Ruud (2019). All-electron fully relativistic Kohn–Sham theory for solids using Gaussian-type basis functions.
  • Kenneth Ruud (2019). Towards the calculation of multidimensional vibrational spectra.
  • Geir Villy Isaksen (2019). Computational Understanding of Biocatalytic Evolution to Extreme Environments.
  • Geir Villy Isaksen (2019). Entropy Calculations in the PchB-catalyzed chorismate mutase reaction..
  • Erik Tellgren; Trygve Helgaker & Sangita Sen (2019). Unifying kinetic energy density and current density in density-functional theory.
  • Erik Tellgren; Trygve Helgaker & Sangita Sen (2019). Unifying kinetic energy density and current density in density-functional theory.
  • Erik Tellgren; Trygve Helgaker & Sangita Sen (2019). Unifying kinetic energy density and current density in density-functional theory.
  • Thomas Bondo Pedersen (2019). Electron Dynamics in Extreme Laser Pulses: A Challenge to Coupled-Cluster Theory.
  • Thomas Bondo Pedersen (2019). Can Coupled-Cluster Theory Describe Ultrashort, High-Intensity Laser-Driven Electron Dynamics?.
  • Kathrin Helen Hopmann (2019). Is your mechanism corect? Insights into Organometallic Hydrogenation and Carboxylation Reactions.
  • Kathrin Helen Hopmann (2019). Is your mechanism correct? Insights into Hydrogenation and Carboxylation Reactions.
  • Ainara Nova (2019). Rational Design of Homogeneous and Heterogeneous Catalysts for CO2 Hydrogenation to Methanol.
  • Ainara Nova (2019). Mechanistic Insight into the Hydrogenation of Amides by Noyori-type Bifunctional Catalysts.
  • Ainara Nova (2019). Computational design of multivariate MOFs for CO2 conversion to methanol.
  • Roberto Di Remigio (2019). Diagrammatic Coupled Cluster Monte Carlo.
  • Geir Villy Isaksen (2019). The entropy challenge in enzyme-catalyzed reactions – are QM methods approaching classical brute force calculations?.
  • Andre Laestadius (2019). Monotonicity in Coupled-Cluster Methods.
  • Andre Laestadius; Markus Penz; Erik Tellgren; Michael Ruggenthaler; Simen Kvaal & Trygve Helgaker (2019). Guaranteed convergence of a regularized Kohn-Sham iteration in finite dimensions.
  • Karen Oda Hjorth Dundas (2019). Let's be pedantic: When you ask for an IR intensity, what are you really calculating?.
  • Lukas Konecny; Marius Kadek; Kenneth Ruud & Michal Repisky (2019). Relativistic real-time time-dependent density functional theory for molecular properties.
  • Lukas Konecny; Michal Repisky; Kenneth Ruud & Stanislav Komorovsky (2019). Relativistic four-component linear damped response time-dependent density functional theory.
  • Kenneth Ruud (2019). Calculating molecular properties: From real-time method to (quasi)-energy derivatives.
  • Marius Kadek; Michal Repisky & Kenneth Ruud (2019). All-electron fully relativistic Kohn–Sham theory for solids using Gaussian-type basis functions.
  • Marius Kadek; Michal Repisky & Kenneth Ruud (2019). All-electron fully relativistic Kohn–Sham theory for solids using Gaussian-type basis functions.
  • Kenneth Ruud (2019). Computational approaches to linear and nonlinear chiroptical spectroscopy.
  • Kenneth Ruud (2019). Computational optical spectroscopy.
  • Karen Oda Hjorth Dundas (2019). Determination of IR and Raman spectra by means of Polarizable Embedding Method.
  • Michele Cascella (2019). Simulating Biological Systems Coupling Particles and Fields with Molecular Dynamics.
  • Michele Cascella (2019). Multiscale simulations of bio/soft-matter using particles and fields.
  • Michele Cascella (2019). Simulating biological soft systems coupling particles and fields with molecular dynamics.
  • Michele Cascella (2019). Simulating biological systems coupling particles and fields with molecular dynamics.
  • Michele Cascella (2019). Simulating biological systems coupling particles and fields with molecular dynamics.
  • Michele Cascella (2019). Simulating biological systems coupling particles and fields with molecular dynamics.
  • Luca Frediani (2019). MRChem: Quantum Chemistry at the basis set limit with Multiwavelets.
  • Julie Denise Josette Héron & David Balcells (2019). Computational Study of the Catalyst Activation of the Cu2AAC reaction.
  • Trygve Helgaker (2019). Chemistry in a strong magnetic field.
  • Trygve Helgaker (2019). Quantum-Chemical Calculations of NMR Parameters.
  • Odile Eisenstein (2019). Some insight in the mechanism of the Grignard reaction.
  • Trygve Helgaker (2019). Robust All-Electron Optimization of Orbital-Free Density-Functional Theory.
  • Odile Eisenstein (2019). Computations trying to catch up with experiments.
  • Odile Eisenstein (2019). « Quantum based » Computational chemistry: An interpret for structures and properties during chemical reaction.
  • Odile Eisenstein (2019). The 13C Solid State NMR Signature of Metal-bonded Carbon: An information of Bonding and Reactivity.
  • Odile Eisenstein (2019). Reactivity in organometallic complexes from Dynamic and solid-state NMR.
  • Trygve Helgaker (2019). Egil A. Hylleraas - a pioneer of computational quantum mechanics.
  • Trygve Helgaker (2019). Chemistry in a Strong Magnetic Field.
  • Trygve Helgaker (2019). Robust All-Electron Optimization of Orbital-Free Density-Functional Theory.
  • Trygve Helgaker (2019). Robust All-Electron Optimization of Orbital-Free Density-Functional Theory.
  • Trygve Helgaker (2019). Robust All-Electron Optimization of Orbital-Free Density-Functional Theory.
  • Trygve Helgaker (2019). Geometry optimization.
  • Trygve Helgaker (2019). Time-independent molecular properties.
  • Trygve Helgaker (2019). Molecules in magnetic fields.
  • Odile Eisenstein; Christophe Raynaud; Christophe Coperet; Richard A Andersen & Christopher Gordon (2019). To have and have not: the NMR signature of metal-C p bond.
  • Trygve Helgaker (2019). Molecular Magnetic Properties.
  • Odile Eisenstein; Christophe Raynaud & Christophe Coperet (2019). Anisotropy of solid state NMR Chemical Shift signal informs on the π character of M-alkyl σ-bond in d0metal alkyl complexes.
  • Odile Eisenstein (2019). Information about reactivity from NMR? An approach combining solid state NMR and quantum calculations.
  • Odile Eisenstein (2019). Challenging computational chemistry with chemical questions.
  • Odile Eisenstein (2019). Anisotropy of Solid State NMR Chemical Shift Signal and the Analysis of the Metal Alkyl Bond in d0 Metal Alkyl Complexes.
  •  (2019). CUBE3 - Computational Understanding of Biocatalytic Evolution to Extreme Environments.
  •  (2019). VR-teknologi og molekylær kjemi.
  •  (2019). Datakraft gir forskerne bedre intuisjon og flere ideer.
  •  (2019). Forskerne ved Hylleraas-senteret jakter på kjemiens hellige gral.
  •  (2019). Kan sjaman Durek Verrett snu atomer? – Vi snur atomkjernene hver dag i vitenskap og medisin, svarer forsker.
  •  (2019). SpectroscPy: Python tools for spectroscopy.
  • Lluis Artus Suarez (2018). Computational study on amide hydrogenolysis to methanol and amine..
  • Lluis Artus Suarez (2018). Computational study on amide hydrogenolysis to methanol and amine..
  • Kenneth Ruud (2018). Optical Probe Sensors at Biological Environments OPS@BE.
  • Trygve Helgaker (2018). Hylleraas Centre for Quantum Molecular Sciences — Ny giv i nytt senter, kvinnelige rollemodeller og nytt initiativ til karrierestøtte,.
  • Trygve Helgaker (2018). Hylleraas Centre for Quantum Molecular Sciences.
  • Geir Villy Isaksen (2018). Empirical Valence Bond..
  • Kenneth Ruud (2018). Relativt god kjemi.
  • Trygve Helgaker (2018). Kvantemekanikk og kjemi.
  • Trygve Helgaker (2018). Utenomjordisk kjemi.
  • Odile Eisenstein (2018). Chemistry: the Color of Universe.
  • Sangita Sen (2018). Excited Molecules in Strong Magnetic Fields.
  • Heike Fliegl; Trygve Helgaker & Erik Tellgren (2018). The effect of strong magnetic fields on the ring currents of tetraoxaisophlorin.
  • Elisa Rebolini; Gustav Baardsen; Audun Skau Hansen; Karl Roald Leikanger & Thomas Bondo Pedersen (2018). Error-controlled MP2 for periodic molecular systems.
  • Audun Skau Hansen; Gustav Baardsen; Lorenzo Maschio & Thomas Bondo Pedersen (2018). Locality and sparsity in local correlation calculations.
  • Lluis Artus Suarez; Ainara Nova; David Balcells & Mats Tilset (2018). Hydrogenation of amides to methanol and amines with an iron-based catalyst. A computational study..
  • Lluis Artus Suarez; Ainara Nova; David Balcells & Mats Tilset (2018). Computational study on the iron-catalyzed hydrogenation of amides to methanol and amines.
  • Gustav Baardsen; Elisa Rebolini; Audun Skau Hansen; Lorenzo Maschio; Karl Roald Leikanger & Thomas Bondo Pedersen (2018). The divide-expand-consolidate method for extended systems.
  • Geir Villy Isaksen; Johan Åqvist & Bjørn Olav Brandsdal (2018). Computation of Enzyme Temperature Adaptation - Protein Surface Softness Regulates the Enthalpy-Entropy Balance..
  • Kenneth Ruud; Swapan Chakrabarti & Lopa Paul (2018). Anomalous phosphorescence in organic and organometallic systems.
  • Kenneth Ruud (2018). Novel Chiroptical Spectroscopies.
  • Kenneth Ruud (2018). Vibrational optical activity and absolute configuration of natural products.
  • Marius Kadek (2018). 4-component self-consistent field method for periodic systems using Gaussian-type basis.
  • Marius Kadek (2018). Band gap opens due to spin-orbit interaction in 2D materials.
  • David Balcells (2018). Rational Design of Pd and Ni Catalysts for Cross-Coupling Reactions by Minimizing Off-Cycle Species.
  • Michele Cascella (2018). Coarse-graining peptides -- From particles to fields.
  • Michele Cascella (2018). Coarse-graining peptides -- from particles to fields.
  • Kathrin Helen Hopmann (2018). Selectivity! (ICIQ).
  • Heike Fliegl (2018). Linking magnetically induced currents to optical properties.
  • Heike Fliegl (2018). Theoretical studies as a tool for understanding the aromatic character of porphyrinoid compounds.
  • Michele Cascella (2018). Coarse grained models of protein and peptides using particles and fields.
  • Michele Cascella (2018). Entropy-driven polymorphism in micellar aggregates of a charged surfactant — a multi-scale study.
  • Heike Fliegl (2018). Theoretical studies as a tool for understanding the aromatic character of porphyrinoid compounds.
  • Kenneth Ruud (2018). Going big and complex.
  • Kenneth Ruud (2018). Relativistic effects in chemistry: Relatively unimportant?.
  • Kenneth Ruud (2018). Modeling nonlinear and multidimensional spectroscopies in complex systems.
  • Kenneth Ruud (2018). Reliable modeling of multiphoton absorption cross sections in complex (molecular) systems.
  • Kenneth Ruud; Lopa Paul & Swapan Chakrabarti (2018). Phosphorescence and triplet lasing in organic and organometallic systems.
  • Thomas Bondo Pedersen (2018). New Directions in Coupled-Cluster Theory.
  • Ainara Nova (2018). Towards the Conversion of Carbon Dioxide to Methanol: A Computational Study on the Iron-Catalyzed Hydrogenation of Amides.
  • Ainara Nova (2018). New Approaches to the Conversion of CO2 to Methanol.
  • Ainara Nova (2018). Computational Insight into the Conversion of CO2 to Methanol.
  • Roberto Di Remigio (2018). The Nordic Quantum Chemistry Library Ecosystem.
  • Magnus Ringholm & Kenneth Ruud (2018). 2D-IR spectroscopy with Wilson and OpenRSP.
  • Kathrin Helen Hopmann (2018). Useful Chemicals from CO2.
  • Kathrin Helen Hopmann (2018). Is Your Mechanism Correct? A Critical View on Computational Catalysis.
  • Kathrin Helen Hopmann (2018). Is Your Mechanism Correct? A Critical View on the Modelling of Reaction Mechanisms.
  • Kathrin Helen Hopmann (2018). Is Your Mechanism Correct? A Critical View on the Modelling of Reaction Mechanisms.
  • Marius Kadek (2018). Role of time-reversal symmetry in relativistic band-structure calculations of solids.
  • Kenneth Ruud (2018). Relativistic Real-time Calculations of Molecular Properties.
  • Kenneth Ruud (2018). Relativistic calculations of molecular properties in the time and frequency domain.
  • Kenneth Ruud (2018). Relativistic effects in chemistry: Relatively unimportant?.
  • Andre Laestadius; Markus Penz; Erik Tellgren; Michael Ruggenthaler; Simen Kvaal & Trygve Helgaker (2018). Generalized Kohn-Sham iteration on Banach Spaces.
  • Andre Laestadius & Simen Kvaal (2018). ANALYSIS OF THE EXTENDED COUPLED-CLUSTER METHOD IN QUANTUM CHEMISTRY.
  • Andre Laestadius; Fabian Maximilian Faulstich; Simen Kvaal; Örs Legeza & Reinhold Schneider (2018). The Study of Coupled-Cluster Methods Using Strong Monotonicity.
  • Andre Laestadius; Fabian Maximilian Faulstich; Simen Kvaal; Örs Legeza & Reinhold Schneider (2018). Analysis of The Coupled-Cluster Method Tailored by Tensor-Network States in Quantum Chemistry.
  • Thomas Bondo Pedersen & Simen Kvaal (2018). Time-Dependent Coupled-Cluster Theory.
  • Thomas Bondo Pedersen & Simen Kvaal (2018). Electron Dynamics with Coupled-Cluster Theory.
  • Michele Cascella (2018). Hybrid particle field models for peptide chains.
  • Michele Cascella (2018). Hybrid particle-field molecular dynamics: state of the art and challenges.
  • Michele Cascella (2018). Toward Molecular-Resolved Mesoscale Simulations of Soft Matter.
  • Trygve Helgaker (2018). Chemistry in Strong Magnetic Fields.
  • Trygve Helgaker (2018). Four-Way Correspondence of Density-Functional Theory.
  • Trygve Helgaker; Alex Borgoo; Jurgen Gauss; Florian Hampe; Wim Klopper; Sarah Reimann; Stella Stopkowicz; Andrew Michael Teale & Erik Tellgren (2018). Closed-Shell Molecular Paramagnetism.
  • Trygve Helgaker; Alex Borgoo; Jurgen Gauss; Florian Hampe; Wim Klopper; Sarah Reimann; Stella Stopkowicz; Andrew M. Teale & Erik Tellgren (2018). Closed-Shell Molecular Paramagnetism.
  • Trygve Helgaker (2018). Molecular Derivatives and Properties.
  • Trygve Helgaker (2018). Closed-Shell Molecular Paramagnetism.
  • Trygve Helgaker; Alex Borgoo; Maria Dimitrova; Jurgen Gauss; Florian Hampe; Christof Holzer; Wim Klopper; Trond Saue; Peter Schwerdtfeger; Stella Stopkowicz; Dage Sundholm; Andrew Michael Teale & Erik Tellgren (2018). Diamagnetism and Paramagnetism in Atoms and Molecules.
  • David Balcells (2018). Minimizing Off-Cycle Species in Palladium- and Nickel-Catalyzed Cross-Coupling Reactions.
  • David Balcells (2018). Minimizing Off-Cycle Species in the Design of New Catalysts for Cross-Coupling Reactions.
  • Geir Villy Isaksen (2018). SAM hydrolase (SVI-3) reaction mechanism.
  • Odile Eisenstein (2018). Analyzing reaction pathway: is there an alternative to energy ?.
  • Odile Eisenstein (2018). Information about reactivity from NMR? An approach combining solid state NMR and quantum calculations.
  • Odile Eisenstein (2018). Analyzing reaction pathway Is there an alternative to energy?.
  • Odile Eisenstein (2018). The adventures of a computational chemist among chemists.
  • Odile Eisenstein (2018). Information about reactivity from NMR? An approach combining solid state NMR and quantum calculations.
  • Odile Eisenstein; Christophe Raynaud & Christophe Coperet (2018). Information about reactivity from NMR? An approach combining solid state NMR and quantum calculations.
  • Odile Eisenstein (2018). Information about reactivity from NMR? An approach combining solid state NMR and quantum calculations.
  •  (2018). Nytt «designer-molekyl» kan spare industrien for store beløp.
  •  (2018). OpenRSP Version v.1.0.0-alpha.
  • Helen Vikdal Thorbjørnsrud (2018). Escaping Mediocrity - Activity and Regulation of a Catalytically Inefficient Enzyme. Series of dissertations submitted to the Faculty of Mathematics and Natural Sciences, University of Oslo.. 1983.
  • Sarah Reimann (2018). Treatment of Magnetic Fields in Density-Functional Theory. Series of dissertations submitted to the Faculty of Mathematics and Natural Sciences, University of Oslo.. 2027.
  • Raphael Mathias Peltzer (2018). Multi-scale computational modelling of bio-chemical systems in the condensed phase. Series of dissertations submitted to the Faculty of Mathematics and Natural Sciences, University of Oslo.. 2058.
  • Trygve Helgaker (2017). CTCC Review.
  • Trygve Helgaker (2017). Hylleraas Centre.
  • Karen Oda Hjorth Dundas (2017). Polarizable embedding and response theory.
  • Kenneth Ruud (2017). Modeling one- and multiphoton absorption in biomolecular systems.
  • Kenneth Ruud (2017). Qualitative insight into multiphoton absorption cross sections.
  • Trygve Helgaker (2017). Four-Way Correspondence of Density-Functional Theory.
  • Marius Kadek; Michal Repisky & Kenneth Ruud (2017). 4-component relativistic calculations with periodic boundary conditions.
  • Kenneth Ruud (2017). Modeling nonlinear and multidimensional spectroscopies in complex systems.
  • Michele Cascella (2017). Coarse-graining peptides -- From particles to fields.
  • Thomas Bondo Pedersen (2017). Coupled-cluster theory: Quo Vadis?.
  • Audun Skau Hansen (2017). Stochastic optimization of block Toeplitz matrices.
  • Audun Skau Hansen (2017). Stochastic optimization of block-Toeplitz matrices.

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Published May 8, 2019 10:35 AM - Last modified Dec. 15, 2020 12:11 PM