Search results
- 1.0398109 - ÚFCH JH 2014 RIV NL eng J - Journal Article
Fišer, J. - Polák, Rudolf
On the theoretical description of nuclear quadrupole coupling in Π states of small molecules.
Chemical Physics. Roč. 425, NOV 2013 (2013), s. 126-133. ISSN 0301-0104. E-ISSN 1873-4421
Institutional support: RVO:61388955
Keywords : Π States * Nuclear quadrupole coupling constant * Electric dipole moment
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.028, year: 2013
Permanent Link: http://hdl.handle.net/11104/0225687 - 2.0388829 - ÚFCH JH 2014 RIV NL eng J - Journal Article
Fišer, J. - Polák, Rudolf
The ZnO2+ dication in the gas phase.
Chemical Physics Letters. Roč. 558, FEB 2013 (2013), s. 8-14. ISSN 0009-2614. E-ISSN 1873-4448
Institutional support: RVO:61388955
Keywords : CONFIGURATION-INTERACTION CALCULATIONS * LYING ELECTRONIC STATES * PHOTOELECTRON-SPECTROSCOPY
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 1.991, year: 2013
Permanent Link: http://hdl.handle.net/11104/0217734 - 3.0375919 - ÚFCH JH 2013 RIV NL eng J - Journal Article
Fišer, J. - Polák, Rudolf
A theoretical study of spectroscopy and metastability of the CN2+ dication.
Chemical Physics. Roč. 392, č. 1 (2012), s. 55-62. ISSN 0301-0104. E-ISSN 1873-4421
Institutional research plan: CEZ:AV0Z40400503
Keywords : CN * CN+ * CN2+
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 1.957, year: 2012
Permanent Link: http://hdl.handle.net/11104/0208456 - 4.0348587 - ÚFCH JH 2011 RIV NL eng J - Journal Article
Polák, Rudolf - Fišer, J.
Theoretical study of electric field gradients at nitrogen nuclei in HNO, CH3NO and C2H3NO.
Chemical Physics. Roč. 375, č. 1 (2010), s. 85-91. ISSN 0301-0104. E-ISSN 1873-4421
Institutional research plan: CEZ:AV0Z40400503
Keywords : nitroxyl * HNO * nitrosomethane
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.017, year: 2010
Permanent Link: http://hdl.handle.net/11104/0189090 - 5.0326118 - ÚFCH JH 2010 RIV NL eng J - Journal Article
Fišer, J. - Polák, Rudolf
A theoretical study of the BO2+ dication.
[Teoretická studie dikationtu BO2+.]
Chemical Physics Letters. Roč. 471, 4-6 (2009), s. 198-201. ISSN 0009-2614. E-ISSN 1873-4448
R&D Projects: GA AV ČR 1ET400400410; GA AV ČR IAA400400504
Institutional research plan: CEZ:AV0Z40400503
Keywords : configuration-integration calculations * spectrum * boron * spectroscopy * stability
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.291, year: 2009
Permanent Link: http://hdl.handle.net/11104/0005247 - 6.0315856 - ÚOCHB 2009 RIV US eng J - Journal Article
Špirko, Vladimír - Polák, Rudolf
Potential energy function of CN-.
[Funkce potenciální energie CN-.]
Journal of Molecular Spectroscopy. Roč. 248, č. 1 (2008), s. 77-80. ISSN 0022-2852. E-ISSN 1096-083X
R&D Projects: GA MŠMT LC512; GA AV ČR IAA400550511; GA AV ČR IAA400400504
Institutional research plan: CEZ:AV0Z40550506; CEZ:AV0Z40400503
Keywords : potential energy curve * fundamental transition * spectroscopic constants
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 1.636, year: 2008
Permanent Link: http://hdl.handle.net/11104/0165946 - 7.0309579 - ÚFCH JH 2009 RIV NL eng J - Journal Article
Polák, Rudolf - Fišer, J.
Theoretical study of 14N quadrupole coupling constants in some NO-containing complexes: N2O3 and FNO.
[Teoretická studie konstant 14N jaderné kvadrupólové vazby v některých komplexech obsahujících NO: N2O3 a FNO.]
Chemical Physics. Roč. 351, 1-3 (2008), s. 83-90. ISSN 0301-0104. E-ISSN 1873-4421
R&D Projects: GA AV ČR 1ET400400410; GA AV ČR IAA400400504
Institutional research plan: CEZ:AV0Z40400503
Keywords : dinitrogen trioxide * N2O3 * nitrosyl fluoride * FNO
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 1.961, year: 2008
Permanent Link: http://hdl.handle.net/11104/0161669 - 8.0302780 - URE-Y 950099 RIV CZ eng J - Journal Article
Lörinčík, Jan - Polák, Rudolf - Šroubek, Zdeněk - Paidarová, Ivana
Comparative study on the variable screening and hartree-fock models as means for the construction of two-center correlation diagrams.
Collection of Czechoslovak Chemical Communications. Roč. 60, č. 2 (1995), s. 161-171. ISSN 0010-0765
Grant - others:GA AV(CZ) 16757/92
Impact factor: 0.550, year: 1995
Permanent Link: http://hdl.handle.net/11104/0113127 - 9.0181854 - UFCH-W 20030301 RIV GB eng J - Journal Article
Fišer, J. - Boublík, T. - Polák, Rudolf
Combining Rule for Interaction Energies of the (CO)2, (N2)2 and CO-N2 Complexes.
Molecular Physics. Roč. 101, 23/24 (2003), s. 3409-3418. ISSN 0026-8976. E-ISSN 1362-3028
R&D Projects: GA ČR GA203/00/0600
Institutional research plan: CEZ:AV0Z4040901
Keywords : interaction energies * CO-N2 complexes
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 1.591, year: 2003
Permanent Link: http://hdl.handle.net/11104/0078368 - 10.0181689 - UFCH-W 20030116 RIV NL eng J - Journal Article
Polák, Rudolf - Fišer, J.
On the Behavior of the Low-Lying 2.SIGMA.+ Electronic States of NO.
Chemical Physics Letters. Roč. 377, 5/6 (2003), s. 564-570. ISSN 0009-2614. E-ISSN 1873-4448
R&D Projects: GA ČR GA203/01/1274
Institutional research plan: CEZ:AV0Z4040901
Keywords : nitric oxide * excited electronic state * electric field gradient
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.438, year: 2003
Permanent Link: http://hdl.handle.net/11104/0001924