Radovan Bast
Senioringeniør - Faggruppe forskning og formidling
Stillingsbeskrivelse
- Rådgivning innen digitale forskningstjenester
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
Rahul Kumar Jinger,
Heike Fliegl,
Radovan Bast,
Maria Dimitrova,
Susi Lehtola,
Dage Sundholm
:
Spatial Contributions to Nuclear Magnetic Shieldings
Trond Saue,
Radovan Bast,
Andre Severo Pereira Gomes,
Hans-Jørgen Aa. Jensen,
Luuk Visscher,
Ignacio Agustín Aucar
m.fl.:
The DIRAC code for relativistic molecular calculations
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
Ole Jacob Broch,
Raymond Nepstad,
Ingrid H. Ellingsen,
Radovan Bast,
Geir Morten Skeie,
JoLynn Carroll
:
Simulating crude oil exposure, uptake and effects in North Atlantic Calanus finmarchicus populations
JoLynn Carroll,
Frode Bendiksen Vikebø,
Daniel Howell,
Ole Jacob Broch,
Raymond Nepstad,
Starrlight Augustine
m.fl.:
Assessing impacts of simulated oil spills on the Northeast Arctic cod fishery
Nidal Saleh,
Radovan Bast,
Nicolas Vanthuyne,
Christian Roussel,
Trond Saue,
Benoit Darquie
m.fl.:
An oxorhenium complex bearing a chiral cyclohexane-1-olato-2-thiolato ligand: Synthesis, stereochemistry, and theoretical study of parity violation vibrational frequency shifts
Chirality 2018 DOI
Cristina A Barboza,
Radovan Bast,
Ezequiel Barboza,
Desmond MacLeod-Carey,
Ramiro Arratia-Perez
:
Magnetically induced current density using London atomic orbitals of dihydroindeno-[1,2-b]-fluorenes
New Journal of Chemistry 2018 DOI
Małgorzata Olejniczak,
Radovan Bast,
Andre Severo Pereira Gomes
:
On the calculation of second-order magnetic properties using subsystem approaches in a relativistic framework
Physical Chemistry, Chemical Physics - PCCP 2017 DOI
Erik Donovan Hedegård,
Radovan Bast,
Jacob Kongsted,
Jógvan Magnus Haugaard Olsen,
Hans Jørgen Aagaard Jensen
:
Relativistic Polarizable Embedding
Journal of Chemical Theory and Computation 2017 DOI
Michal Repisky,
Stanislav Komorovsky,
Radovan Bast,
Kenneth Ruud
:
Relativistic Calculations of Nuclear Magnetic Resonance Parameters
Royal Society of Chemistry (RSC) 2016 DOI
Roberto Di Remigio,
Radovan Bast,
Luca Frediani,
Trond Saue
:
Four-Component Relativistic Calculations in Solution with the Polarizable Continuum Model of Solvation: Theory, Implementation and Application to the Group 16 Dihydrides H2X (X= O, S, Se, Te, Po)
Magnus Ringholm,
Radovan Bast,
Luca Oggioni,
Ulf Egil Ekström,
Kenneth Ruud
:
Analytic calculations of hyper-Raman spectra from density functional theory hyperpolarizability gradients
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
S Pathak,
Radovan Bast,
Kenneth Ruud
:
Multiconfigurational Self-Consistent Field Calculations of the Magnetically Induced Current Density Using Gauge-Including Atomic Orbitals
Journal of Chemical Theory and Computation 2013 DOI
Malgorzata Olejniczak,
Radovan Bast,
Trond Saue,
Magdalena Pecul
:
A simple scheme for magnetic balance in four-component relativistic Kohn-Sham calculations of nuclear magnetic resonance shielding constants in a Gaussian basis
Journal of Chemical Physics 2012 DOI
Alexander Biebricher,
Ove Havnes,
Radovan Bast
:
On the necessary complexity of modeling of the Polar Mesosphere Summer Echo Overshoot Effect
Journal of Plasma Physics 2012 DOI
Pawel Tecmer,
Radovan Bast,
Kenneth Ruud,
Lucas Visscher
:
Charge-Transfer Excitations in Uranyl Tetrachloride ([UO2Cl4](2-)): How Reliable are Electronic Spectra from Relativistic Time-Dependent Density Functional Theory?
Journal of Physical Chemistry A 2012 DOI
Kenneth Ruud,
Radovan Bast,
Bin Gao,
Andreas johan Thorvaldsen,
Ulf Egil Ekström,
Lucas Visscher
:
A General Toolbox for the Calculation of Higher-Order Molecular Properties Using SCF Wave Functions at the One-, Two- and Four-Component Levels of Theory
AIP Conference Proceedings 2012 DOI
David Sulzer,
Małgorzata Olejniczak,
Radovan Bast,
Trond Saue
:
4-Component relativistic magnetically induced current density using London atomic orbitals
Physical Chemistry, Chemical Physics - PCCP 2011 DOI
R Orlando,
Radovan Bast,
Kenneth Ruud,
Ulf Egil Ekström,
M Ferrabone,
B Kirtman
:
The First and Second Static Electronic Hyperpolarizabilities of Zigzag Boron Nitride Nanotubes. An ab Initio Approach through the Coupled Perturbed Kohn-Sham Scheme
Journal of Physical Chemistry A 2011 DOI
Radovan Bast,
Ekstrom Ulf,
Bin Gao,
Trygve Helgaker,
Kenneth Ruud,
Andreas johan Thorvaldsen
:
The ab initio calculation of molecular electric, magnetic and geometric properties
Physical Chemistry, Chemical Physics - PCCP 2011 DOI
Radovan Bast,
Anton Koers,
Andre Severo Pereira Gomes,
Miroslav Ilias,
Lucas Visscher,
Peter Schwerdtfeger
m.fl.:
Analysis of parity violation in chiral molecules
Physical Chemistry, Chemical Physics - PCCP 2011 DOI
Rodrigo Ramírez-Tagle,
Leonor Alvarado-Soto,
Ramiro Arratia-Perez,
Radovan Bast,
Luis Alvarez-Thon
:
Probing the aromaticity of the [(HtAc)(3)(mu(2)-H)(6)], [(HtTh)(3)(mu(2)-H)(6)],(+), and [(HtPa)(3)(mu(2)-H)(6)] clusters
Journal of Chemical Physics 2011 DOI
Radovan Bast,
Kenneth Ruud,
Antonio Rizzo,
Trygve Helgaker
:
Relativistic four-component calculations of Buckingham birefringence using London atomic orbitals
Benoit Darquie,
Clara Stoeffler,
Alexander Shelkovnikov,
C Daussy,
A Amy-Klein,
Christian Chardonnet
m.fl.:
Progress Toward the First Observation of Parity Violation in Chiral Molecules by High-Resolution Laser Spectroscopy
Chirality 2010 DOI
Frederic De Montigny,
Radovan Bast,
Andre Severo Pereira Gomes,
Guillaume Pilet,
Nicolas Vanthuyne,
Christian Roussel
m.fl.:
Chiral oxorhenium(v) complexes as candidates for the experimental observation of molecular parity violation: a structural, synthetic and theoretical study
Physical Chemistry, Chemical Physics - PCCP 2010 DOI
Ulf Ekstrøm,
Lucas Visscher,
Radovan Bast,
Andreas johan Thorvaldsen,
Kenneth Ruud
:
Arbitrary-Order Density Functional Response Theory from Automatic Differentiation
Journal of Chemical Theory and Computation 2010 DOI
R Orlando,
V Lacivita,
Radovan Bast,
Kenneth Ruud
:
Calculation of the first static hyperpolarizability tensor of three-dimensional periodic compounds with a local basis set: A comparison of LDA, PBE, PBE0, B3LYP, and HF results
Journal of Chemical Physics 2010 DOI
Radovan Bast,
HJAA Jensen,
Trond Saue
:
Relativistic Adiabatic Time-Dependent Density Functional Theory Using Hybrid Functionals and Noncollinear Spin Magnetization
International Journal of Quantum Chemistry 2009 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
Radovan Bast,
Trond Saue,
Johan Henriksson,
Patrick Norman
:
Role of noncollinear magnetization for the first-order electric-dipole hyperpolarizability at the four-component Kohn--Sham density functional theory level
Journal of Chemical Physics 2009 DOI
Radovan Bast,
Roberto Di Remigio
:
CMake Cookbook
2018
Radovan Bast,
Kathleen Alexandra Smart
:
Good practices for sharing data and software in a FAIR way
2023
Anna Endresen,
Laura Alexis Janda,
Radovan Bast,
Valentina Zhukova
:
The database of the Russian Constructicon
2022
Laura Alexis Janda,
Anna Endresen,
Radovan Bast
:
Lansering av Det russiske konstruktikonet
2021 DATA
Laura Alexis Janda,
Radovan Bast,
Francis Morton Tyers,
Svetlana Sokolova,
Mikhail Kopotev,
Ekaterina Rakhilina
m.fl.:
SMARTool: Strategic Mastery of Russian Tool
Laura Alexis Janda,
Radovan Bast,
Francis Morton Tyers
:
Rik morfologi og kognitive realiteter
2021
Radovan Bast,
Anna Endresen,
Laura Alexis Janda,
Marianne Cecilie Lund,
Olga Lyashevskaya,
Daria Mordashova
m.fl.:
The Russian Constructicon
2021 FULLTEKST
Anna Endresen,
Radovan Bast,
Laura Alexis Janda,
Valentina Alexandrovna Zhukova,
Daria Mordashova
:
International Launch of the Russian Constructicon
Kenneth Ruud,
Magnus Ringholm,
Radovan Bast,
Daniel Henrik Friese,
Bin Gao,
Dan Johan Jonsson
:
OpenRSP Version v.1.0.0
2020 DATA
Laura Alexis Janda,
Radovan Bast
:
Nå blir det mye lettere å lære et nytt språk
Laura Alexis Janda,
Radovan Bast
:
SMARTool Open Science Talk Podcast
13. mars 2020 FULLTEKST
Laura Alexis Janda,
Radovan Bast
:
Tromsø-forskere lanserte nytt gratis verktøy for å lære språk
13. februar 2020 FULLTEKST
Laura Alexis Janda,
Radovan Bast
:
Nå blir det lettere å lære et nytt språk
14. februar 2020 FULLTEKST
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,
Radovan Bast,
Daniel Henrik Friese,
Bin Gao,
Dan Johan Jonsson,
Kenneth Ruud
m.fl.:
Analytic high-order properties with OpenRSP
2016
Magnus Ringholm,
Radovan Bast,
Bin Gao,
Dan Johan Jonsson,
Andreas johan Thorvaldsen,
Kenneth Ruud
:
The recursive open-ended response code OpenRSP
2014
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
Adam Chamberlin,
Radovan Bast,
Kenneth Ruud
:
Identifying relativistic effects on (hyper)polarizabilities
Abstract of Papers of the American Chemical Society 2012
De 50 siste resultatene fra Cristin vises på siden. Se alle arbeider i Cristin her →