| 1 |
Reactions of 2-Propanol Radical with Halogenated Organics in Aqueous Solution: Theoretical Evidence for Proton-Coupled Electron Transfer and Competing Mechanisms
Ljubic I, Sabljic A, Bonifacic M
Journal of Physical Chemistry B, 120(45), 11810, 2016 |
| 2 |
CASSCF/CASPT2 and TD-DFT Study of Valence and Rydberg Electronic Transitions in Fluorene, Carbazole, Dibenzofuran, and Dibenzothiophene
Ljubic I, Sabljic A
Journal of Physical Chemistry A, 115(18), 4840, 2011 |
| 3 |
Bioavailability of Xenobiotics in the Soil Environment
Katayama A, Bhula R, Burns GR, Carazo E, Felsot A, Hamilton D, Harris C, Kim YH, Kleter G, Koedel W, Linders J, Peijnenburg JGMW, Sabljic A, Stephenson RG, Racke DK, Rubin B, Tanaka K, Unsworth J, Wauchope RD
Reviews of Environmental Contamination and Toxicology, 203, 1, 2010 |
| 4 |
Theoretical study of structure, vibrational frequencies, and electronic spectra of dibenzofuran and its polychlorinated derivatives
Ljubic I, Sabljic A
Journal of Physical Chemistry A, 111(7), 1339, 2007 |
| 5 |
Theoretical study of structure, vibrational frequencies, and electronic spectra of polychlorinated dibenzo-p-dioxins
Ljubic I, Sabljic A
Journal of Physical Chemistry A, 110(13), 4524, 2006 |
| 6 |
Ozonolysis of fluoroethene: Theoretical study of unimolecular decomposition paths of primary and secondary fluorozonide
Ljubic I, Sabljic A
Journal of Physical Chemistry A, 109(10), 2381, 2005 |
| 7 |
Dibenzo-p-dioxin. An ab initio CASSCF/CASPT2 study of the pi-pi* and pi-pi* valence excited states
Ljubic I, Sabljic A
Journal of Physical Chemistry A, 109(36), 8209, 2005 |
| 8 |
Systematic CASPT2 analysis of the geometry and force field of ozone with extrapolation to the infinite basis set
Ljubic I, Sabljic A
Chemical Physics Letters, 385(3-4), 214, 2004 |
| 9 |
Theoretical study of the mechanism and kinetics of gas-phase ozone additions to ethene, fluoroethene, and chloroethene: A multireference approach
Ljubic I, Sabljic A
Journal of Physical Chemistry A, 106(18), 4745, 2002 |
| 10 |
Direct dynamic studies on tropospheric reactivity of fluorinated ethanes: Scope and limitations of the general reaction parameter method
Sekusak S, Sabljic A
Journal of Physical Chemistry A, 105(10), 1968, 2001 |
