Search results
- 1.0181818 - UFCH-W 20030260 RIV NL eng J - Journal Article
Schröder, D. - Loos, J. - Schwarz, H. - Thissen, R. - Roithová, Jana - Herman, Zdeněk
Does Ionized Diacetylene have a Positive Proton Affinity?
International Journal of Mass Spectrometry. Roč. 230, - (2003), s. 113-121. ISSN 1387-3806. E-ISSN 1873-2798
R&D Projects: GA AV ČR KJB4040302
Institutional research plan: CEZ:AV0Z4040901
Keywords : charge reversal * charge stripping * density functional theory
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.361, year: 2003
Permanent Link: http://hdl.handle.net/11104/0078336 - 2.0181730 - UFCH-W 20030164 RIV US eng J - Journal Article
Roithová, Jana - Žabka, Ján - Hrušák, Jan - Thissen, R. - Herman, Zdeněk
Dynamics of Chemical and Charge Transfer Reactions of Molecular Dications: IV. Proton Transfer and Reactions of Dication Isomers in the CHCl2+ +D2 System.
Journal of Physical Chemistry A. Roč. 107, - (2003), s. 7347-7354. ISSN 1089-5639. E-ISSN 1520-5215
R&D Projects: GA ČR GA203/00/0632; GA AV ČR KJB4040302
Grant - others:Barrande(FR) 2002-013-1
Institutional research plan: CEZ:AV0Z4040901
Keywords : dynamics of chemical * molecular dications * proton transfer
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.792, year: 2003
Permanent Link: http://hdl.handle.net/11104/0001930 - 3.0181727 - UFCH-W 20030161 RIV US eng J - Journal Article
Roithová, Jana - Hrušák, Jan - Herman, Zdeněk
An ab initio Study of the Potential Energy Surface of the Reaction CHCl2+ + H2 and Comparison with Experimental Data.
Journal of Physical Chemistry A. Roč. 107, - (2003), s. 7355-7363. ISSN 1089-5639. E-ISSN 1520-5215
R&D Projects: GA ČR GA203/00/0632; GA AV ČR KJB4040302
Institutional research plan: CEZ:AV0Z4040901
Keywords : ab initio study * reaction CHCl2+ + H2 * experimental data
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.792, year: 2003
Permanent Link: http://hdl.handle.net/11104/0001929 - 4.0181675 - UFCH-W 20030102 RIV NL eng J - Journal Article
Roithová, Jana - Hrušák, Jan - Herman, Zdeněk
A Theoretical Study of the Ground and Excited States of the CHCl2+ Dication and the CHCl+ Cation.
International Journal of Mass Spectrometry. Roč. 228, - (2003), s. 497-506. ISSN 1387-3806. E-ISSN 1873-2798
R&D Projects: GA ČR GA203/00/0632; GA AV ČR KJB4040302; GA MŠMT ME 561
Institutional research plan: CEZ:AV0Z4040901
Keywords : dications * ground and excited states * ionization energy
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.361, year: 2003
Permanent Link: http://hdl.handle.net/11104/0078209 - 5.0181669 - UFCH-W 20030096 RIV GB eng J - Journal Article
Roithová, Jana - Žabka, Ján - Thissen, R. - Herman, Zdeněk
Dynamics of Chemical and Charge Transfer Reactions of Molecular Dications: Part V. An Experimental and Theoretical Study of Reactions between CHCl2+ and Ar, Kr and Xe.
Physical Chemistry Chemical Physics. Roč. 5, - (2003), s. 2988-2995. ISSN 1463-9076. E-ISSN 1463-9084
R&D Projects: GA ČR GA203/00/0632; GA AV ČR KJB4040302
Grant - others:Konktakt Barrande(XE) 2002-013-1
Institutional research plan: CEZ:AV0Z4040901
Keywords : charge-transfer * experimental and theoretical study * molecular dications
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 1.959, year: 2003
Permanent Link: http://hdl.handle.net/11104/0078203 - 6.0093626 - ÚFCH JH 2008 RIV NL eng J - Journal Article
Feketeová, L. - Tepnual, T. - Grill, V. - Roithová, Jana - Herman, Zdeněk - Märk, T. D.
Surface-induced dissociation and reactions of cations and dications C7H8 center dot+/2+, C7H7+/center dot 2+ and C7H62+: Dependence of mass spectra of product ions on incident energy of the projectiles.
[Disociace a reakce kationtů a dikationtů C7H8+/2+, C7H7+/2+,a C7H62 indukované srážkou s povrchem: Závislost hmotnostních specter produktů na energii dopadajících projektilových iontů.]
International Journal of Mass Spectrometry. Roč. 265, - (2007), s. 337-346. ISSN 1387-3806. E-ISSN 1873-2798
R&D Projects: GA AV ČR KJB4040302; GA AV ČR IAA4040405
Institutional research plan: CEZ:AV0Z40400503
Keywords : toluene * ion-surface collisions * surface-induced-dissociation
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.411, year: 2007
Permanent Link: http://hdl.handle.net/11104/0153625 - 7.0093622 - ÚFCH JH 2008 RIV NL eng J - Journal Article
Jašík, J. - Roithová, Jana - Žabka, Ján - Thissen, R. - Ipolyi, I. - Herman, Zdeněk
Dynamics of chemical and charge transfer reactions of molecular dications: VI reactions of C4H32+ with Kr, Xe, H-2, N-2, NO, NH3, C2H2, and CH4.
[Dynamika chemických reakcí a reakcí přenosu náboje molekulových dikationtů: VI. Reakce C4H32+ s Kr, Xe, H2, N2, NO, NH3, C2H2 a CH4.]
International Journal of Mass Spectrometry. 255-256, - (2006), s. 150-163. ISSN 1387-3806. E-ISSN 1873-2798
R&D Projects: GA AV ČR KJB4040302
Institutional research plan: CEZ:AV0Z40400503
Keywords : reaction dynamics * molecular dications * charge-transfer * proton transfer
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.337, year: 2006
Permanent Link: http://hdl.handle.net/11104/0153622 - 8.0089558 - ÚOCHB 2008 RIV NL eng J - Journal Article
Milko, Petr - Roithová, Jana - Schröder, Detlef - Schwarz, H.
Doubly protonated 1,3,5-trimethylenebenzene (C9H112+) and homologous C7H72+ and C8H92+ dications: structures and unimolecular fragmentation patterns.
[Dvojnásobně protonovaný 1,3,5-trimethylen benzen (C9H112+) a homologické dikationty C7H72+ and C8H92+: struktury a unimolekulární fragmentační schémata.]
International Journal of Mass Spectrometry. Roč. 267, 1/3 (2007), s. 139-147. ISSN 1387-3806. E-ISSN 1873-2798
R&D Projects: GA AV ČR KJB4040302
Institutional research plan: CEZ:AV0Z40550506
Keywords : dications * DFT calculations * mass spectrometry * protonation * triradicals
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.411, year: 2007
Permanent Link: http://hdl.handle.net/11104/0150734 - 9.0089554 - ÚOCHB 2008 RIV NL eng J - Journal Article
Roithová, Jana - Schröder, Detlef
Substituent effects on the second ionization energies of hydroxy- and methoxy benzenes.
[Substituční efekt na druhou ionizační energii hydroxy- a methoxy benzenů.]
International Journal of Mass Spectrometry. Roč. 267, 1/3 (2007), s. 134-138. ISSN 1387-3806. E-ISSN 1873-2798
R&D Projects: GA AV ČR KJB4040302; GA AV ČR KJB400550704
Institutional research plan: CEZ:AV0Z40550506
Keywords : dication * electron transfer * ionization energy * phenol * quinone
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.411, year: 2007
Permanent Link: http://hdl.handle.net/11104/0150730 - 10.0089465 - ÚOCHB 2008 RIV GB eng J - Journal Article
Roithová, Jana - Schröder, Detlef - Míšek, Jiří - Stará, Irena G. - Starý, Ivo
Chiral superbases: The proton affinities of 1- and 2-aza[6]helicene in the gas phase.
[Chirální superbáze: protonové afinity 1- and 2-aza[6]helicenů v plynné fázi.]
Journal of Mass Spectrometry. Roč. 42, č. 9 (2007), s. 1233-1237. ISSN 1076-5174. E-ISSN 1096-9888
R&D Projects: GA AV ČR KJB4040302; GA AV ČR KJB400550704
Grant - others:Framework Programme(XE) LSHC-CT-2006-015847
Institutional research plan: CEZ:AV0Z40550506
Source of funding: R - Framework programmes of European Commission
Keywords : azahelicenes * density functional theory * kinetic method * proton affinity
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.062, year: 2007
Permanent Link: http://hdl.handle.net/11104/0150671