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Physical Chemistry Chemical Physics : PCCP
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August 14, 2015
X-ray absorption resonances near L2,3-edges from real-time propagation of the Dirac-Kohn-Sham density matrix
Marius Kadek, Lukas Konecny, Bin Gao, et al.
The Journal of Chemical Physics
|
December 4, 2018
Resolution-of-identity accelerated relativistic two- and four-component electron dynamics approach to chiroptical spectroscopies
Lukas Konecny, Marius Kadek, Stanislav Komorovsky, et al.
The Journal of Physical Chemistry Letters
|
February 9, 2023
Accurate Relativistic Real-Time Time-Dependent Density Functional Theory for Valence and Core Attosecond Transient Absorption Spectroscopy
Torsha Moitra, Lukas Konecny, Marius Kadek, et al.
The Journal of Physical Chemistry Letters
|
August 28, 2025
Light-Induced Persistent Electronic Chirality in Achiral Molecules Probed with Time-Resolved Electronic Circular Dichroism Spectroscopy
Torsha Moitra, Lukas Konecny, Marius Kadek, et al.
Journal of Chemical Theory and Computation
|
October 30, 2016
Acceleration of Relativistic Electron Dynamics by Means of X2C Transformation: Application to the Calculation of Nonlinear Optical Properties
Lukas Konecny, Marius Kadek, Stanislav Komorovsky, et al.
Journal of Chemical Theory and Computation
|
October 24, 2023
Cost-Efficient High-Resolution Linear Absorption Spectra through Extrapolating the Dipole Moment from Real-Time Time-Dependent Electronic-Structure Theory
Eirill Hauge, Håkon Emil Kristiansen, Lukas Konecny, et al.
Journal of Chemical Theory and Computation
|
November 19, 2015
Excitation Energies from Real-Time Propagation of the Four-Component Dirac-Kohn-Sham Equation
Michal Repisky, Lukas Konecny, Marius Kadek, et al.
The Journal of Chemical Physics
|
May 17, 2020
ReSpect: Relativistic spectroscopy DFT program package
Michal Repisky, Stanislav Komorovsky, Marius Kadek, et al.
The Journal of Physical Chemistry. A
|
August 18, 2025
X2C Hamiltonian Models in ReSpect: Bridging Accuracy and Efficiency
Michal Repisky, Stanislav Komorovsky, Lukas Konecny, et al.
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of 1
Search research articles
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Showing results (1-10 of 9) with videos related to
Sort By:
Page
of 1
Physical Chemistry Chemical Physics : PCCP
|
August 14, 2015
X-ray absorption resonances near L2,3-edges from real-time propagation of the Dirac-Kohn-Sham density matrix
Marius Kadek, Lukas Konecny, Bin Gao, et al.
The Journal of Chemical Physics
|
December 4, 2018
Resolution-of-identity accelerated relativistic two- and four-component electron dynamics approach to chiroptical spectroscopies
Lukas Konecny, Marius Kadek, Stanislav Komorovsky, et al.
The Journal of Physical Chemistry Letters
|
February 9, 2023
Accurate Relativistic Real-Time Time-Dependent Density Functional Theory for Valence and Core Attosecond Transient Absorption Spectroscopy
Torsha Moitra, Lukas Konecny, Marius Kadek, et al.
The Journal of Physical Chemistry Letters
|
August 28, 2025
Light-Induced Persistent Electronic Chirality in Achiral Molecules Probed with Time-Resolved Electronic Circular Dichroism Spectroscopy
Torsha Moitra, Lukas Konecny, Marius Kadek, et al.
Journal of Chemical Theory and Computation
|
October 30, 2016
Acceleration of Relativistic Electron Dynamics by Means of X2C Transformation: Application to the Calculation of Nonlinear Optical Properties
Lukas Konecny, Marius Kadek, Stanislav Komorovsky, et al.
Journal of Chemical Theory and Computation
|
October 24, 2023
Cost-Efficient High-Resolution Linear Absorption Spectra through Extrapolating the Dipole Moment from Real-Time Time-Dependent Electronic-Structure Theory
Eirill Hauge, Håkon Emil Kristiansen, Lukas Konecny, et al.
Journal of Chemical Theory and Computation
|
November 19, 2015
Excitation Energies from Real-Time Propagation of the Four-Component Dirac-Kohn-Sham Equation
Michal Repisky, Lukas Konecny, Marius Kadek, et al.
The Journal of Chemical Physics
|
May 17, 2020
ReSpect: Relativistic spectroscopy DFT program package
Michal Repisky, Stanislav Komorovsky, Marius Kadek, et al.
The Journal of Physical Chemistry. A
|
August 18, 2025
X2C Hamiltonian Models in ReSpect: Bridging Accuracy and Efficiency
Michal Repisky, Stanislav Komorovsky, Lukas Konecny, et al.
Page
of 1