Magnus Ringholm
A Larasati Soenarjo,
Zhihao Lan,
Igor V. Sazanovich,
Yee San Chan,
Magnus Ringholm,
Ajay Jha
m.fl.:
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
m.fl.:
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
m.fl.:
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
m.fl.:
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
m.fl.:
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
m.fl.:
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
m.fl.:
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
m.fl.:
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. desember 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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