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Journal of Chemical Theory and Computation
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June 21, 2024
Approximate Functionals for Multistate Density Functional Theory
Alexander Humeniuk
The Journal of Chemical Physics
|
June 24, 2016
Non-adiabatic dynamics around a conical intersection with surface-hopping coupled coherent states
Alexander Humeniuk, Roland Mitrić
The Journal of Chemical Physics
|
November 24, 2014
Excited states from quantum Monte Carlo in the basis of Slater determinants
Alexander Humeniuk, Roland Mitrić
The Journal of Chemical Physics
|
October 10, 2015
Long-range correction for tight-binding TD-DFT
Alexander Humeniuk, Roland Mitrić
Journal of Chemical Theory and Computation
|
February 8, 2024
Multistate, Polarizable QM/MM Embedding Scheme Based on the Direct Reaction Field Method: Solvatochromic Shifts, Analytical Gradients and Optimizations of Conical Intersections in Solution
Alexander Humeniuk, William J Glover
Journal of the American Chemical Society
|
April 15, 2024
Vibrational Motions in Ultrafast Electronic Relaxation of Pyrazine
Shutaro Karashima, Alexander Humeniuk, Toshinori Suzuki
The Journal of Physical Chemistry. A
|
June 14, 2014
Exploring ultrafast dynamics of pyrazine by time-resolved photoelectron imaging
Gaia Tomasello, Alexander Humeniuk, Roland Mitrić
Physical Chemistry Chemical Physics : PCCP
|
October 10, 2018
Exciton localization in excited-state dynamics of a tetracene trimer: a surface hopping LC-TDDFTB study
Evgenii Titov, Alexander Humeniuk, Roland Mitrić
Journal of Chemical Theory and Computation
|
October 17, 2022
Conical Intersections in Solution with Polarizable Embedding: Integral-Exact Direct Reaction Field
Xiao Liu, Alexander Humeniuk, William J Glover
The Journal of Physical Chemistry. A
|
November 27, 2020
Size Dependence of Non-Radiative Decay Rates in J-Aggregates
Alexander Humeniuk, Roland Mitrić, Vlasta Bonačić-Koutecký
Page
of 3
Search research articles
Search
Showing results (1-10 of 28) with videos related to
Sort By:
Page
of 3
Journal of Chemical Theory and Computation
|
June 21, 2024
Approximate Functionals for Multistate Density Functional Theory
Alexander Humeniuk
The Journal of Chemical Physics
|
June 24, 2016
Non-adiabatic dynamics around a conical intersection with surface-hopping coupled coherent states
Alexander Humeniuk, Roland Mitrić
The Journal of Chemical Physics
|
November 24, 2014
Excited states from quantum Monte Carlo in the basis of Slater determinants
Alexander Humeniuk, Roland Mitrić
The Journal of Chemical Physics
|
October 10, 2015
Long-range correction for tight-binding TD-DFT
Alexander Humeniuk, Roland Mitrić
Journal of Chemical Theory and Computation
|
February 8, 2024
Multistate, Polarizable QM/MM Embedding Scheme Based on the Direct Reaction Field Method: Solvatochromic Shifts, Analytical Gradients and Optimizations of Conical Intersections in Solution
Alexander Humeniuk, William J Glover
Journal of the American Chemical Society
|
April 15, 2024
Vibrational Motions in Ultrafast Electronic Relaxation of Pyrazine
Shutaro Karashima, Alexander Humeniuk, Toshinori Suzuki
The Journal of Physical Chemistry. A
|
June 14, 2014
Exploring ultrafast dynamics of pyrazine by time-resolved photoelectron imaging
Gaia Tomasello, Alexander Humeniuk, Roland Mitrić
Physical Chemistry Chemical Physics : PCCP
|
October 10, 2018
Exciton localization in excited-state dynamics of a tetracene trimer: a surface hopping LC-TDDFTB study
Evgenii Titov, Alexander Humeniuk, Roland Mitrić
Journal of Chemical Theory and Computation
|
October 17, 2022
Conical Intersections in Solution with Polarizable Embedding: Integral-Exact Direct Reaction Field
Xiao Liu, Alexander Humeniuk, William J Glover
The Journal of Physical Chemistry. A
|
November 27, 2020
Size Dependence of Non-Radiative Decay Rates in J-Aggregates
Alexander Humeniuk, Roland Mitrić, Vlasta Bonačić-Koutecký
Page
of 3