Magnus Ringholm
A Larasati Soenarjo,
Zhihao Lan,
Igor V. Sazanovich,
Yee San Chan,
Magnus Ringholm,
Ajay Jha
et al.:
The Transition from Unfolded to Folded G-Quadruplex DNA Analyzed and Interpreted by Two-Dimensional Infrared Spectroscopy
Karen Oda Hjorth Dundas,
Maarten Beerepoot,
Magnus Ringholm,
Simen Sommerfelt Reine,
Radovan Bast,
Nanna Holmgaard List
et al.:
Harmonic Infrared and Raman Spectra in Molecular Environments Using the Polarizable Embedding Model
Jógvan Magnus Haugaard Olsen,
Simen Sommerfelt Reine,
Olav Vahtras,
Erik Kjellgren,
Peter Reinholdt,
Karen O.H Dundas
et al.:
Dalton Project: A Python platform for molecular- and electronic-structure simulations of complex systems
Zilvinas Rinkevicius,
Xin Li,
Olav Vahtras,
Karan Ahmadzadeh,
Manuel Brand,
Magnus Ringholm
et al.:
VeloxChem: A Python‐driven density‐functional theory program for spectroscopy simulations in high‐performance computing environments
Wiley Interdisciplinary Reviews. Computational Molecular Science 2019 DOI
W. James Morgan,
Devin A Matthews,
Magnus Ringholm,
Jay Agarwal,
Justin Z Gong,
Kenneth Ruud
et al.:
Geometric Energy Derivatives at the Complete Basis Set Limit: Application to the Equilibrium Structure and Molecular Force Field of Formaldehyde.
Marco Anelli,
Magnus Ringholm,
Kenneth Ruud
:
Gauge-origin independent calculations of electric-field-induced second-harmonic generation circular intensity difference using London atomic orbitals
Roberto Di Remigio,
Maarten Beerepoot,
Yann Cornaton,
Magnus Ringholm,
Arnfinn Hykkerud Steindal,
Kenneth Ruud
:
Open-ended formulation of self-consistent field response theory with the polarizable continuum model for solvation
Yann Cornaton,
Magnus Ringholm,
Orian Louant,
Kenneth Ruud
:
Analytic calculations of anharmonic infrared and Raman vibrational spectra
Yann Cornaton,
Magnus Ringholm,
Kenneth Ruud
:
Complete analytic anharmonic hyper-Raman scattering spectra
Arnfinn Hykkerud Steindal,
Maarten Beerepoot,
Magnus Ringholm,
Nanna Holmgaard List,
Kenneth Ruud,
Jacob Kongsted
:
Open-ended response theory with polarizable embedding: multiphoton absorption in biomolecular systems
Daniel Henrik Friese,
Magnus Ringholm,
Bin Gao,
Kenneth Ruud
:
Open-Ended Recursive Calculation of Single Residues of Response Functions for Perturbation-Dependent Basis Sets
Daniel Henrik Friese,
Maarten Beerepoot,
Magnus Ringholm,
Kenneth Ruud
:
Open-ended recursive approach for the calculation of multiphoton absorption matrix elements
Magnus Ringholm,
Radovan Bast,
Luca Oggioni,
Ulf Egil Ekström,
Kenneth Ruud
:
Analytic calculations of hyper-Raman spectra from density functional theory hyperpolarizability gradients
Bin Gao,
Magnus Ringholm,
Radovan Bast,
Kenneth Ruud,
Andreas johan Thorvaldsen,
Michał Jaszuński
:
Analytic density functional theory calculations of pure vibrational hyperpolarizabilities: The first dipole hyperpolarizability of retinal and related molecules
Magnus Ringholm,
Dan Johan Jonsson,
Radovan Bast,
Bin Gao,
Andreas johan Thorvaldsen,
Ulf Ekstrøm
et al.:
Analytic cubic and quartic force fields using density-functional theory
Magnus Ringholm,
Dan Johan Jonsson,
Kenneth Ruud
:
A general, recursive, and open-ended response code
Journal of Computational Chemistry 2014 DOI
Abdelsalam Mohammed,
Hans Ågren,
Magnus Ringholm,
Andreas johan Thorvaldsen,
Kenneth Ruud
:
Hyper Raman spectra calculated in a time-dependent Hartree-Fock method
Molecular Physics 2012 DOI
Radovan Bast,
Andreas johan Thorvaldsen,
Magnus Ringholm,
Kenneth Ruud
:
Atomic orbital-based cubic response theory for one-, two-, and four-component relativistic self-consistent field models
Chemical Physics 2009 DOI
Magnus Ringholm,
Patrick Norman
:
Second-quantization Liouville-space response theory for H0 non-eigenstates
2024
Magnus Ringholm,
Patrick Norman
:
Liouville-space approximate-state response theory
2024
Vanda Le,
Magnus Ringholm
:
Benchmarking of quantum-chemical simulation of 2D-IR spectroscopy
2024
Vanda Le,
Magnus Ringholm
:
Benchmarking of quantum-chemical simulation of 2D-IR spectroscopy
2024
Magnus Ringholm,
Patrick Norman
:
Liouville-space approximate-state response theory
2023
Magnus Ringholm,
Patrick Norman
:
Liouville-space approximate-state response theory
2023
Vanda Le,
Magnus Ringholm
:
PyOpenRSP, the CEO of analytic response properties
2023
Vanda Le,
Magnus Ringholm
:
PyOpenRSP: Analytic Molecular Response Properties for Spectroscopy
2023
Vanda Le,
Magnus Ringholm
:
PyOpenRSP, the CEO of analytic response properties
2023
Jonas Vester,
David Carrasco-Busturia,
Kenneth Ruud,
Magnus Ringholm,
Jógvan Magnus Haugaard Olsen
:
Benchmarks and Workflow for Fragment-based Polarizable Embedding (PE): Calculations of Harmonic IR and Raman Spectra
2022
Magnus Ringholm,
Patrick Norman
:
Approximate-state response theory in Liouville space
2022
Kenneth Ruud,
Magnus Ringholm,
Radovan Bast,
Daniel Henrik Friese,
Bin Gao,
Dan Johan Jonsson
:
OpenRSP Version v.1.0.0
2020 DATA
Karen Oda Hjorth Dundas,
Magnus Ringholm,
Benedicte Ofstad,
Yann Cornaton
:
SpectroscPy: Python tools for spectroscopy
2019 DATA
Magnus Ringholm,
Nanna Holmgaard List,
Patrick Norman
:
Approaches for pulsed external fields: A comparison
2019
Magnus Ringholm
:
Design practices I like
2019
Magnus Ringholm,
Nanna Holmgaard List,
Patrick Norman
:
Pulsed external fields and molecular responses
2019
Kenneth Ruud,
Magnus Ringholm,
Radovan Bast,
Daniel Henrik Friese,
Bin Gao,
Dan Johan Jonsson
et al.:
OpenRSP Version v.1.0.0-alpha
2018 DATA
Magnus Ringholm,
Kenneth Ruud
:
2D-IR spectroscopy with Wilson and OpenRSP
2018
Magnus Ringholm,
Kenneth Ruud
:
Simulating vibrational wave-mixing experiments with Wilson
2017
Magnus Ringholm,
Kenneth Ruud
:
Simulating vibrational spectroscopic experiments with Wilson
2017
Magnus Ringholm,
Radovan Bast,
Daniel Henrik Friese,
Bin Gao,
Dan Johan Jonsson,
Kenneth Ruud
et al.:
Analytic high-order properties with OpenRSP
2016
Magnus Ringholm,
Kenneth Ruud,
Dan Johan Jonsson
:
General Vibrational Spectroscopies with Wilson
2016
Magnus Ringholm,
Kenneth Ruud,
Dan Johan Jonsson
:
General Vibrational Spectroscopies with Wilson
2016
Magnus Ringholm,
Dan Johan Jonsson,
Kenneth Ruud
:
General vibrational spectroscopies with Wilson
2015
Magnus Ringholm
:
Molekylegenskaper med OpenRSP
Kjemi 2015
Daniel Henrik Friese,
Kenneth Ruud,
Magnus Ringholm
:
High-order non-linear optical and chiroptical property calculations using an open-ended recursive approach
2015
Benedicte Ofstad,
Per-Olof Åstrand,
Magnus Ringholm,
Kenneth Ruud
:
Vibrational motion in molecules
2014
Daniel Henrik Friese,
Maarten Beerepoot,
Magnus Ringholm,
Kenneth Ruud
:
Multiphoton absorption calculation using an open-ended response theory approach - Going beyond one- and two-photon absorption
2014
Magnus Ringholm,
Radovan Bast,
Bin Gao,
Dan Johan Jonsson,
Andreas johan Thorvaldsen,
Kenneth Ruud
:
The recursive open-ended response code OpenRSP
2014
Vibeke Os,
Magnus Ringholm
:
Nye muligheter for kjemiske databeregninger
11. December 2013 FULLTEKST
Magnus Ringholm,
Kenneth Ruud
:
Recursive calculation of high-order molecular response properties
UiT Norges arktiske universitet 2013
Magnus Ringholm,
Radovan Bast,
Bin Gao,
Dan Johan Jonsson,
Andreas johan Thorvaldsen,
Kenneth Ruud
:
A general, recursive open-ended response code: High-order SCF level properties
2013
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