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Demel, Ondřej
33
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Online (33)
Mediatypes
Articles (Online) (30)
OpenAccess-fulltext (3)
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1
Hilbert space multireference coupled cluster tailored by ma..:
Demel, Ondřej
;
Brandejs, Jan
;
Lang, Jakub
...
The Journal of Chemical Physics. 159 (2023) 22 - p. , 2023
Link:
https://doi.org/10.1063/..
?
2
Further investigations into a Laplace MP2 method using rang..:
Demel, Ondřej
;
Lecours, Michael J.
;
Nooijen, Marcel
The Journal of Chemical Physics. 158 (2023) 11 - p. , 2023
Link:
https://doi.org/10.1063/..
?
3
Toward Laplace MP2 method using range separated Coulomb pot..:
Demel, Ondřej
;
Lecours, Michael J.
;
Habrovský, Richard
.
The Journal of Chemical Physics. 155 (2021) 15 - p. , 2021
Link:
https://doi.org/10.1063/..
?
4
Toward the efficient local tailored coupled cluster approxi..:
Antalík, Andrej
;
Veis, Libor
;
Brabec, Jiří
...
The Journal of Chemical Physics. 151 (2019) 8 - p. , 2019
Link:
https://doi.org/10.1063/..
?
5
Perturbative triples correction to domain-based local pair ..:
Lang, Jakub
;
Brabec, Jiří
;
Saitow, Masaaki
...
Physical Chemistry Chemical Physics. 21 (2019) 9 - p. 5022-5038 , 2019
Link:
https://doi.org/10.1039/..
?
6
Domain-Based Local Pair Natural Orbital Version of Mukherje..:
Brabec, Jiri
;
Lang, Jakub
;
Saitow, Masaaki
...
Journal of Chemical Theory and Computation. 14 (2018) 3 - p. 1370-1382 , 2018
Link:
https://doi.org/10.1021/..
?
7
A MRCC study of the isomerisation of cyclopropane:
Lang, Jakub
;
Švaňa, Matej
;
Demel, Ondřej
...
Molecular Physics. 115 (2017) 21-22 - p. 2743-2754 , 2017
Link:
https://doi.org/10.1080/..
?
8
Multireference Equation of Motion Coupled Cluster study of ..:
Liu, Zhebing
;
Demel, Ondřej
;
Nooijen, Marcel
Journal of Molecular Spectroscopy. 311 (2015) - p. 54-63 , 2015
Link:
https://doi.org/10.1016/..
?
9
A Local Pair Natural Orbital-Based Multireference Mukherjee..:
Demel, Ondřej
;
Pittner, Jiří
;
Neese, Frank
Journal of Chemical Theory and Computation. 11 (2015) 7 - p. 3104-3114 , 2015
Link:
https://doi.org/10.1021/..
?
10
Benchmark Applications of Variations of Multireference Equa..:
Huntington, Lee M. J.
;
Demel, Ondřej
;
Nooijen, Marcel
Journal of Chemical Theory and Computation. 12 (2015) 1 - p. 114-132 , 2015
Link:
https://doi.org/10.1021/..
?
11
Insight into the Structure of Layered Zinc Hydroxide Salts ..:
Demel, Jan
;
Hynek, Jan
;
Kovář, Petr
...
The Journal of Physical Chemistry C. 118 (2014) 46 - p. 27131-27141 , 2014
Link:
https://doi.org/10.1021/..
?
12
Communication: Multireference equation of motion coupled cl..:
Nooijen, Marcel
;
Demel, Ondřej
;
Datta, Dipayan
...
The Journal of Chemical Physics. 140 (2014) 8 - p. , 2014
Link:
https://doi.org/10.1063/..
?
13
Perturbative triples correction for explicitly correlated M..:
Demel, Ondřej
;
Kedžuch, Stanislav
;
Noga, Jozef
.
Molecular Physics. 111 (2013) 16-17 - p. 2477-2488 , 2013
Link:
https://doi.org/10.1080/..
?
14
Additional global internal contraction in variations of mul..:
Demel, Ondřej
;
Datta, Dipayan
;
Nooijen, Marcel
The Journal of Chemical Physics. 138 (2013) 13 - p. , 2013
Link:
https://doi.org/10.1063/..
?
15
Multireference coupled cluster study of the oxyallyl diradi..:
Šimsa, Daniel
;
Demel, Ondřej
;
Bhaskaran-Nair, Kiran
...
Chemical Physics. 401 (2012) - p. 203-207 , 2012
Link:
https://doi.org/10.1016/..
1-15