2005

28. ‘A gas-phase study of the gold-catalyzed coupling of alkynes and alcohols’
J. Roithová, J. Hrušák, D. Schröder, H. Schwarz, Inorg. Chim. Acta 2005, 358, 4287 – 4292.
27. ‘Competitive Complexation of Gaseous MnII by 1,10-Phenanthroline, 2,2’-Bipyridine, and 4,5-Diazafluorene’
N. Tsierkezos, M. Diefenbach, J. Roithová, D. Schröder, H. Schwarz, Inorg. Chem. 2005, 44, 4969 – 4978.
26. ‘Unimolecular fragmentation of CH3NH2: Towards a mechanistic description of HCN formation’
J. Roithová, D. Schröder, H. Schwarz, Eur. J. Org. Chem. 2005, 3304 – 3313.
25. ‘Ring-substituted benzohydroxamic acids: 1H, 13C and 15N NMR spectra and NH-OH proton exchange’
J. Schraml, M. Tkadlecová, S. Pataridis, L. Soukupová, V. Blechta, J. Roithová, O. Exner, Magn. Reson. Chem. 2005, 43, 535 – 542.
24. ‘Generation of the Elusive meta-Benzoquinone in the Gas Phase’
J. Roithová, D. Schröder, H. Schwarz, Angew. Chem. 2005, 117, 3152 – 3156.
23. ‘Decomposition of neutral, singly and doubly protonated benzoquinone in the gas phase’
J. Roithová, D. Schröder, H. Schwarz, Chem. Eur. J. 2005, 11, 628 – 638.
22. ‘Revision of the second ionization energy of toluene’
J. Roithová, D. Schröder, J. Loos, H. Schwarz, H.-Ch. Jankowiak, R. Berger, R. Thissen, O. Dutuit, J. Chem. Phys. 2005, 122, 094306.

2004

21. ‘N,O-diacylhydroxylamines-structures in crystals and solutions’
J. Schraml, J. Sýkora, P. Fiedler, J. Roithová, J. Mindl, V. Blechta, I. Císařová, O. Exner, Org. Biomol. Chem. 2004, 2(16), 2311 – 2314.
20. ‘Structure of disilylated acetoacetohydroxamic acid’
J. Schraml, J. Hetflejs, S. Sabata, V. Blechta, J. Sykora, J. Roithová, Coll. Czech Chem. Com. 2004, 69(7), 1472 – 1478.
19. ‘Substituent effects in the unimolecular fragmentation of anisole dication derivatives’
J. Roithová, D. Schröder, H. Schwarz, J. Phys. Chem. A 2004, 108 (23), 5060 – 5068.
18. ‘Silylation of N,O-Diacylhydroxylamines: NMR Spectra and Structure of the Products, Organometallics’
J. Schraml, J. Mindl, J. Roithova, V. Blechta, J. Sykora, L. Soukupova, J. Karban, M. Bartlova, O. Exner, Organometallics 2004, 23, 2157 – 2161.

2003

17. ‘Does ionized diacetylene have a positive proton affinity?’
D. Schröder, J. Loos, H. Schwarz, R. Thissen, J. Roithova, Z. Herman, Int. J. Mass Spectrom. 2003, 230, 113 – 121.
16. ‘Internal energy effects in the reactivity of CO22+ doubly charged molecular ions with CO2 and CO’
P. Franceschi, R. Thissen, J. Žabka, J. Roithová, Z. Herman, O. Dutuit, Int. J. Mass. Spectrom. 2003, 228, 507 – 516.
15. ‘Reactions of molecular dications: Collision energy dependence of integral cross sections of processes in CHCl2+ + Ar, D2 systems from guided beam studies’
J. Roithová, R. Thissen, J. Žabka, P. Franceschi, O. Dutuit, Z. Herman, Int. J. Mass Spectrom. 2003, 228, 487 – 495.
14. ‘An ab inition study of the potential energy surface of the reaction CHCl2+ + H2 and comparison with experimental data’
J. Roithová, J. Hrušák, Z. Herman, J. Phys. Chem A 2003, 107, 7355 – 7363.
13. ‘Dynamics of chemical and charge transfer reactions of molecular dications: IV. Proton transfer and reactions of dication isomers in the system CHCl2++ D2′
J. Roithová, J. Žabka, J. Hrušák, R. Thissen, Z. Herman, J. Phys. Chem. A 2003, 107, 7347 – 7354.
12. ‘Dynamics of chemical and charge transfer reactions of molecular dications: V. An experimental and theoretical study of reactions between CHCl2+ and Ar, Kr and Xe’
J. Roithová, J. Žabka, R. Thissen, Z. Herman, Phys. Chem. Chem. Phys. 2003, 5, 2988 – 2995.
11. ‘A theoretical study of the ground and excited states of the CHCl2+ dication and the CHCl+ cation’
J. Roithová, J. Hrušák, Z. Herman, Int. J. Mass Spectrom. 2003, 228, 497 – 506.
10. ‘Surface collisions of the acetonitrile molecular ion: evidence for isomerization of CD3CN+• to the ketenimine cation CD2=C=ND+’
C. Mair, J. Roithová, J. Fedor, M. Lezius, Z. Herman, T. D. Märk, Int. J. Mass Spectrom. 2003, 223, 279 – 290.

2002

9. ‘Energy partitioning in collisions of slow polyatomic ions with carbon surfaces’
J. Žabka, Z. Dolejšek, J. Roithová, V. Grill, T. D. Märk, Z. Herman, Int. J. Mass Spectrom. 2002, 213, 145 – 156.
8. ‘Collisions of slow polyatomic ions with surfaces: Dissociation and chemical reactions of CD5+, CD4+, CD3+, and their isotopic variants on room-temperature and heated carbon surfaces’
J. Roithová, J. Žabka, Z. Dolejšek, Z. Herman, J. Phys. Chem. B 2002, 106, 8293 – 8301.
7. ‘On the nature of C-Li bonding in lithiated hydrocarbons and lithiocarbons’
R. Ponec, J. Roithová, X. Gironés, L. Lain, A. Torre, R. Bochicchio, J. Phys. Chem. A 2002, 106, 1019 – 1025.

2001

6. ‘Trimethylsilyl group migrations in cryogenic ozonolysis of trimethylsilylethene: Evidence for nonconcerted primary ozonide decomposition pathway’
R. Fajgar, J. Roithová, J. Pola, J. Org. Chem. 2001, 21, 6977 – 6981.
5. ‘On the nature of bonding in N5+ ion’
R. Ponec, J. Roithová, X. Gironés, K. Jug, J. Mol. Struct. (Theochem) 2001, 545, 255 – 264.
4. ‘Mechanism of gas phase ethene-ozone reaction and concomitant processes. Theoretical study’
R. Ponec, J. Roithová, Y. Haas, Croat. Chem. Acta 2001, 74, 251 – 264.
3. ‘Domain-averaged Fermi holes – a new means of visualization of chemical bonds. Bonding in hypervalent molecules’
R. Ponec, J. Roithová, Theor. Chem. Acc. 2001, 105, 383 – 392.
2. ‘Protonation of alkylpyridines: polarizability and steric effects in the base and in the cation’
J. Roithová, O. Exner, J. Phys. Org. Chem. 2001, 14, 752 – 758.

2000

1. ‘On the nature of multicenter bonding in simple atomic clusters’
R. Ponec, J. Roithová, A. B. Sannigrahi, L. Lain, A. Torre, R. Bochicchio, J. Mol. Struct. (Theochem) 2000, 505, 283 – 288.