Search results
- 1.0560978 - ÚFCH JH 2023 RIV GB eng J - Journal Article
Veis, Libor
A further step towards the practical application of quantum computing in chemistry.
Communications Chemistry. Roč. 5, JUL 2022 (2022), č. článku 108. ISSN 2399-3669. E-ISSN 2399-3669
Grant - others:GA ČR(CZ) 22-04302L
Institutional support: RVO:61388955
Keywords : quantum computing * computing chemistry * theoretical chemistry
OECD category: Physical chemistry
Impact factor: 5.9, year: 2022
Method of publishing: Open access
Permanent Link: https://hdl.handle.net/11104/0333739File Download Size Commentary Version Access 0560978.pdf 0 500.9 KB open access Publisher’s postprint open-access - 2.0545587 - ÚFCH JH 2022 RIV DE eng M - Monography Chapter
Veis, Libor
Quantum Chemistry on Quantum Computers.
Simulating Correlations with Computers Modeling and Simulation. Jülich: Verlag des Forschungszentrum Jülich, 2021 - (Pavarini, E.; Koch, E.). ISBN 978-3-95806-529-1
Institutional support: RVO:61388955
Keywords : quantum chemistry * quantum computers * theoretical chemistry
OECD category: Physical chemistry
https://www.cond-mat.de/events/correl21/manuscripts/veis.pdf
Permanent Link: http://hdl.handle.net/11104/0322266File Download Size Commentary Version Access 0545587.pdf 3 750.4 KB open access Publisher’s postprint open-access - 3.0507579 - ÚFCH JH 2020 RIV CZ cze J - Journal Article
Berka, K. - Sršeň, Š. - Slavíček, Petr
Je strojové učení budoucností teoretické chemie?
[Is machine learning the future of theoretical chemistry?]
Chemické listy. Roč. 112, č. 10 (2018), s. 640-647. ISSN 0009-2770. E-ISSN 1213-7103
Institutional support: RVO:61388955
Keywords : Artificial intelligence * Machine learning * Neural networks * qsar * Quantum chemistry * Theoretical chemistry
OECD category: Physical chemistry
Impact factor: 0.311, year: 2018
Method of publishing: Open access
Permanent Link: http://hdl.handle.net/11104/0298567File Download Size Commentary Version Access 0507579.pdf 2 531 KB open access Publisher’s postprint open-access - 4.0455795 - ÚFCH JH 2017 RIV US eng J - Journal Article
Tarana, Michal - Čurík, Roman
Adiabatic potential-energy curves of long-range Rydberg molecules: Two-electron R -matrix approach.
Physical Review. A. Roč. 93, č. 1 (2016), s. 012515. ISSN 1050-2947
R&D Projects: GA ČR(CZ) GP14-15989P
Institutional support: RVO:61388955
Keywords : adiabatic-potential-energy curves * Rydberg molecules * theoretical chemistry
OECD category: Physical chemistry
Impact factor: 2.808, year: 2014
Method of publishing: Limited access
Permanent Link: http://hdl.handle.net/11104/0256431File Download Size Commentary Version Access 0455795.pdf 4 615.8 KB Publisher’s postprint require - 5.0370882 - ÚFCH JH 2013 RIV US eng M - Monography Chapter
Čurík, Roman - Horáček, J.
Introduction to numerical methods.
Low-Energy Electron Scattering from Molecules, Biomolecules and Surfaces. 1. Boca Raton: CRC Press, Taylor & Francis Group, 2012 - (Čársky, P.; Čurík, R.), s. 9-43. ISBN 978-1-4398-3910-2
R&D Projects: GA MŠMT OC09079; GA MŠMT(CZ) OC10046; GA ČR GA202/08/0631; GA ČR GAP208/11/0452
Institutional research plan: CEZ:AV0Z40400503
Keywords : numerical methods * theoretical chemistry * single-center expansion
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0204558 - 6.0364877 - ÚCHP 2012 eng, eng U - Conference, Workshop Arrangement
Ponec, Robert
Prague Workshop on Theoretical Chemistry.
[Praha, 26.09.2011-29.09.2011, (W-WRD 19/18)]
Institutional research plan: CEZ:AV0Z40720504
Keywords : theoretical chemistry * new methodologies * chemical bonding
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0200246 - 7.0347582 - ÚFCH JH 2011 RIV US eng J - Journal Article
Civiš, Svatopluk - Matulková, Irena - Cihelka, Jaroslav
Time-resolved Fourier-transform infrared emission spectroscopy of Au in the 1800-4000-cm(-1) region: Rydberg transitions.
Physical Review. A. Roč. 81, č. 1 (2010), 012510. ISSN 1050-2947
R&D Projects: GA AV ČR IAA400400705; GA AV ČR KAN100500652
Institutional research plan: CEZ:AV0Z40400503
Keywords : spectroscopy * Rydberg transitions * theoretical chemistry
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.861, year: 2010
Permanent Link: http://hdl.handle.net/11104/0188333 - 8.0181851 - UFCH-W 20030292 RIV eng U - Conference, Workshop Arrangement
Čársky, Petr - Hrušák, Jan
Central 2nd European Symposium on Theoretical Chemistry.
[Nové Hrady, 25.09.2003-28.09.2003, (K-WRD 78/68)]
Institutional research plan: CEZ:AV0Z4040901
Keywords : theoretical chemistry * chemical physics
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0078365 - 9.0181339 - UFCH-W 20010267 RIV eng U - Conference, Workshop Arrangement
Hobza, Pavel
Summer School on Theoretical and Computational Chemistry.
[Prague, 30.07.2001-03.08.2001, (W-CST 35/0)]
R&D Projects: GA MŠMT LN00A032
Institutional research plan: CEZ:AV0Z4040901
Keywords : theoretical chemistry * computational chemistry
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0077921