| 1 |
Reinvestigation of the Deceptively Simple Reaction of Toluene with OH and the Fate of the Benzyl Radical: The "Hidden" Routes to Cresols and Benzaldehyde
Salta Z, Kosmas AM, Segovia ME, Kieninger M, Tasinato N, Barone V, Ventura ON
Journal of Physical Chemistry A, 124(28), 5917, 2020 |
| 2 |
On the experimental structure of monoperoxocarbonic acid and the enthalpy of formation of carbonic acid, peroxyformic acid and monoperoxocarbonic acid in gas phase
Kieninger M, Mendez PS, Ventura ON
Chemical Physics Letters, 480(1-3), 52, 2009 |
| 3 |
A new perspective in the Lewis acid catalyzed ring opening of epoxides. Theoretical study of some complexes of methanol, acetic acid, dimethyl ether, diethyl ether, and ethylene oxide with boron trifluoride
Saenz P, Cachau RE, Seoane G, Kieninger M, Ventura ON
Journal of Physical Chemistry A, 110(41), 11734, 2006 |
| 4 |
Molecular structure and internal rotation in 2,3,5,6-tetrafluoroanisole as studied by gas-phase electron diffraction and quantum chemical calculations
Belyakov AV, Kieninger M, Cachau RE, Ventura ON, Oberhammer H
Journal of Physical Chemistry A, 109(2), 394, 2005 |
| 5 |
A comparative density functional study of the torsional potential of 4-fluoro (trifluoromethoxy) benzene and related species
Kieninger M, Ventura ON, Diercksen GHF
Chemical Physics Letters, 389(4-6), 405, 2004 |
| 6 |
Complete basis set and density functional determination of the enthalpy of formation of the controversial HO3 radical. A discrepancy between theory and experiment (vol 365, pg 440, 2002)
Denis PA, Kieninger M, Ventura ON, Cachau RE, Diercksen GHF
Chemical Physics Letters, 377(3-4), 483, 2003 |
| 7 |
Density functional computational thermochemistry: Determination of the enthalpy of formation of methanethial-S,S-dioxide (sulfene)
Ventura ON, Kieninger M, Denis PA
Journal of Physical Chemistry A, 107(4), 518, 2003 |
| 8 |
Density functional computational thermochemistry: solving the discrepancy between MO and DFT calculations on the enthalpy of formation of sulfine, CH2=S=O
Ventura ON, Kieninger M, Denis PA, Cachau RE
Chemical Physics Letters, 355(3-4), 207, 2002 |
| 9 |
Complete basis set and density functional determination of the enthalpy of formation of the controversial HO3 radical: a discrepancy between theory and experiment
Denis PA, Kieninger M, Ventura ON, Cachau RE, Diercksen GHF
Chemical Physics Letters, 365(5-6), 440, 2002 |
| 10 |
Density functional computational thermochemistry: Isomerization of sulfine and its enthalpy of formation
Ventura ON, Kieninger M, Denis PA, Cachau RE
Journal of Physical Chemistry A, 105(43), 9912, 2001 |
