Zobrazeno 1 - 10
of 79
pro vyhledávání: '"Aleksandar Sabljić"'
Autor:
Goran Kovačević, Aleksandar Sabljić
Publikováno v:
Croatica Chemica Acta, Vol 88, Iss 4, Pp 547-552 (2015)
The major tropospheric removal process for hexafluorobenzene is its oxidation by hydroxyl (OH) radicals. However, there is no information on the reaction mechanism of this important process. All geometries and energies significant for the tropospheri
Externí odkaz:
https://doaj.org/article/2bb7731552e74c51aa3aded53aaf7f20
Publikováno v:
The Journal of Physical Chemistry B. 120:11810-11820
The reactions of α-hydroxyalkyl radicals in aqueous medium are of interest because they exhibit a rich variety of fundamentally important competing mechanisms, such as proton- coupled electron transfer (PCET), hydrogen atom transfer, free radical su
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::11eb9b3d148dfb7e86fa11879ce01c41
https://doi.org/10.1021/acs.jpcb.6b08765
https://doi.org/10.1021/acs.jpcb.6b08765
Autor:
Goran Kovačević, Aleksandar Sabljić
Publikováno v:
Chemosphere. 159:488-495
Hexachlorobenzene is highly persistent, bioaccumulative, toxic and globally distributed, a model persistent organic pollutant. The major atmospheric removal process for hexachlorobenzene is its oxidation by hydroxyl radicals. Unfortunately, there is
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0f6efbbf60426d87ee8507fc03352953
https://doi.org/10.1016/j.chemosphere.2016.06.026
https://doi.org/10.1016/j.chemosphere.2016.06.026
Autor:
Aleksandar Sabljić, Goran Kovačević
Publikováno v:
Environmental Science: Processes and Impacts
Atmospheric transport is the major route for global distribution of semi-volatile compounds such as halogenated aromatics as well as their major exposure route for humans. Their major atmospheric removal process is oxidation by hydroxyl radicals. The
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::aaf86fda1348a76822e86d96f57e4e9e
https://doi.org/10.1039/c6em00577b
https://doi.org/10.1039/c6em00577b
Publikováno v:
International Journal of Quantum Chemistry. 22:357-362
Although much work has been done concerning the absolute ordering of the occupied π molecular orbitals of 1,4-cyclohexadiene, this ordering has not yet been directly proven. Consequently, the ordering of the vacant π* orbitals cannot be said to be
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::4002ad6b5eadac1060c07e31a0c1b32b
https://doi.org/10.1002/qua.560220836
https://doi.org/10.1002/qua.560220836
Autor:
Wenlin Chen, Aleksandar Sabljic, Steven A. Cryer, Rai S. Kookana, Volker Laabs, William C. Koskinen, Robin Sur, Yoshiaki Nakagawa, Jane Tang, Russell L. Jones, Michael Huang, Richard Allen, Sue Hayes, Sabine Beulke, Wendy van Beinum, Michael Xiao Huang, John R. Purdy, Mark Cheplick, Scott H. Jackson, Laura Suddaby, Robin Oliver, Sui Kuet, Rafael Celis, William Koskinen, Colin Brown, Riaz Ahmad, Annemieke Farenhorst, Ross McQueen, Baljeet Singh, Diane Malley, Gerald Reinken, Russell Jones, Daniel G. Dyer, Peter N. Coody, Timothy Negley, Daniel Dyer, Kacie Gehl, Qingli Ma, A. Rahman, P. T. Holland, T. K. James, D. E. McNaughton
Autor:
Ivan Ljubić, Aleksandar Sabljić
Publikováno v:
The Journal of Physical Chemistry A. 111:1339-1350
Minimum structures and harmonic vibrational frequencies of dibenzofuran (DF), 2,3,7,8-tetrachlorodibenzofuran (TCDF), and octachlorodibenzofuran (OCDF) were calculated using the multiconfigurational complete active space self-consistent field (CASSCF
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::74ab3605095b9be34afe814d17eb570e
https://doi.org/10.1021/jp0676336
https://doi.org/10.1021/jp0676336
Autor:
Aleksandar Sabljić, Goran Kovačević
Publikováno v:
Croatica Chemica Acta
Volume 88
Issue 4
Croatica Chemica Acta, Vol 88, Iss 4, Pp 547-552 (2015)
Volume 88
Issue 4
Croatica Chemica Acta, Vol 88, Iss 4, Pp 547-552 (2015)
The major tropospheric removal process for hexafluorobenzene is its oxidation by hydroxyl (OH) radicals. However, there is no information on the reaction mechanism of this important process. All geometries and energies significant for the tropospheri
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ee00aa099c1d66d155290532bf6bab46
https://hrcak.srce.hr/file/227178
https://hrcak.srce.hr/file/227178
Autor:
Ivan Ljubić, Aleksandar Sabljić
Publikováno v:
The Journal of Physical Chemistry A. 106:4745-4757
Ab initio multiconfigurational CASSCF and CASPT2 methods were employed in studying the reaction mechanisms and kinetics of the gas-phase ozone additions to ethene, fluoroethene, and chloroethene up to the formation of the primary addition products (p
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::423649a8743b5af48b8dadfa49fef918
https://doi.org/10.1021/jp025562e
https://doi.org/10.1021/jp025562e
Publikováno v:
Pure and Applied Chemistry. 73:1331-1348
Degradability of organic compounds in air, soil, and water is the most important factor for evaluating their environment fate as well as possible adverse effects to humans and the environment. The primary degradation process in the troposphere is the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::827982a41aad3a5df235aa144be730bd
https://doi.org/10.1351/pac200173081331
https://doi.org/10.1351/pac200173081331