2024
2024 |
Multireference coupled cluster methods augmented by higher excitations from a DMRG wave function
991724
J. Heyrovský Institute of Physical Chemistry of the CAS, v. v. i. |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2023
2025 |
Excited state molecular dynamics with non-adiabatic and spin-orbit effects assisted by machine learning
23-06364S
Grant Agency of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2019
2021 |
Time evolution of conjugated systems in excited states by surface hopping nonadiabatic molecular dynamics
19-06860S
Grant Agency of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2018
2020 |
Relativistic DMRG-based externally corrected coupled cluster methods
Grant Agency of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2017
2020 |
Nové coupled cluster metody korigované pomocí DMRG: Implementace pro nejnovější generaci superpočítačů a aplikace na komplexy přechodných kovů
Ministry of Education, Youth and Sports of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2016
2018 |
DMRG-based externally corrected multireference coupled cluster methods
Grant Agency of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2016
2018 |
Advanced methods for treatment of systems with static and dynamic correlation based on the density matrix renormalization group technique and their applications
Academy of Sciences of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2014
2015 |
Lokální multireferenční metody vázaných klastrů založené na přístupu párových přirozených orbitalů
Academy of Sciences of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2013
2015 |
Parallel Implementation of Hilbert-space Multireference Coupled Cluster Methods and Application on Excited States
Ministry of Education, Youth and Sports of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2012
2016 |
Ab initio molecular dynamics with non-adiabatic and spin-orbit effects applied to time-dependent fluorescence
Grant Agency of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2011
2015 |
Explicitly correlated multireference coupled cluster methods
Grant Agency of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2008
2011 |
Efficient methods for ab-initio non-adiabatic molecular dynamics
Grant Agency of the Academy of Sciences of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2008
2012 |
Quantum chemistry on quantum computers
Grant Agency of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2007
2010 |
Computer- aided implementation if multireference coupled cluster methods.
Grant Agency of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2005
2011 |
INSTITUTIONAL RESEARCH PLAN: Structure, reactivity and dynamics of molecular and biomolecular systems: theory, experiment, application
Academy of Sciences of the Czech Republic |
prof. RNDr. Samec Zdeněk DrSc.
prof. Ing. ČEJKA Jiří DrSc.
prof. RNDr. Civiš Svatopluk CSc., DSc.
prof. Hof Martin Dr. rer. nat., DSc.
doc. Mgr. Hromadová Magdaléna Ph.D.
prof. RNDr. Kavan Ladislav CSc., DSc.
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
doc. Ing. Sobalík Zdeněk CSc.
|
2004
2006 |
Analytic gradient for the state-specific multireference Brillouin-Wigner coupled cluster method.
Grant Agency of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
2004
2007 |
State specific multireference Brillouin-Wigner coupled cluster method with triexcitations
Grant Agency of the Academy of Sciences of the Czech Republic |
prof. Mgr. Pittner Jiří Dr. rer. nat., DSc.
|
jh-inst.cas.cz
