Effect of cooperative hydrogen bonding in azo− hydrazone tautomerism of azo dyes AS Özen, P Doruker, V Aviyente The Journal of Physical Chemistry A 111 (51), 13506-13514, 2007 | 90 | 2007 |
Modeling the oxidative degradation of azo dyes: a density functional theory study AS Özen, V Aviyente, RA Klein The Journal of Physical Chemistry A 107 (24), 4898-4907, 2003 | 86 | 2003 |
Noncovalent intramolecular interactions in the monomers and oligomers of the acceptor and donor type of low band gap conducting polymers AS Özen, C Atilgan, G Sonmez The Journal of Physical Chemistry C 111 (44), 16362-16371, 2007 | 80 | 2007 |
Experimental and modeling approach to decolorization of azo dyes by ultrasound: degradation of the hydrazone tautomer AS Özen, V Aviyente, G Tezcanli-Güyer, NH Ince The Journal of Physical Chemistry A 109 (15), 3506-3516, 2005 | 74 | 2005 |
Interpretation of hydrogen bonding in the weak and strong regions using conceptual DFT descriptors AS Özen, F De Proft, V Aviyente, P Geerlings The Journal of Physical Chemistry A 110 (17), 5860-5868, 2006 | 58 | 2006 |
Mapping and reverse-mapping of the morphologies for a molecular understanding of the self-assembly of fluorinated block copolymers G Kacar, C Atilgan, AS Ozen The Journal of Physical Chemistry C 114 (1), 370-382, 2010 | 52 | 2010 |
Modeling the substituent effect on the oxidative degradation of azo dyes AS Özen, V Aviyente, F De Proft, P Geerlings The Journal of Physical Chemistry A 108 (28), 5990-6000, 2004 | 51 | 2004 |
Complete mapping of the morphologies of some linear and graft fluorinated co-oligomers in an aprotic solvent by dissipative particle dynamics A Sema Özen, U Sen, C Atilgan The Journal of chemical physics 124 (6), 2006 | 41 | 2006 |
Detection of nitroaromatic explosives based on fluorescence quenching of silafluorene-and silole-containing polymers: A time-dependent density functional theory study B Dedeoglu, A Monari, T Etienne, V Aviyente, AS Ozen The Journal of Physical Chemistry C 118 (41), 23946-23953, 2014 | 34 | 2014 |
Computational insight into the explosive detection mechanisms in silafluorene-and silole-containing photoluminescent polymers B Dedeoglu, V Aviyente, AS Ozen The Journal of Physical Chemistry C 118 (12), 6385-6397, 2014 | 19 | 2014 |
A quantum mechanical approach to the kinetics of the hydrogen abstraction reaction H2O2 + •OH → HO2 + H2O F Atadinc, H Günaydin, AS Özen, V Aviyente International journal of chemical kinetics 37 (8), 502-514, 2005 | 15 | 2005 |
Static and dynamic structure of monomers, dimers and trimers of HgCl2 from density-functional calculations R Ruberto, G Pastore, AS Özen, Z Akdeniz, MP Tosi The European Physical Journal D 66, 1-8, 2012 | 13 | 2012 |
A computational study of the Wallach rearrangement AS Özen, SS Erdem, V Aviyente Structural Chemistry 9, 15-25, 1998 | 13 | 1998 |
The origins of tetrahedral coordination in molten and glassy ZnCl2 and other group-2B metal dihalides AS Özen, Z Akdeniz, R Ruberto, G Pastore, MP Tosi Physics Letters A 378 (4), 431-433, 2014 | 12 | 2014 |
Peripheral and structural effects on the band gap of acceptor–donor type conducting polymers containing pendant bisfulleroid groups AS Özen The Journal of Physical Chemistry C 115 (50), 25007-25018, 2011 | 7 | 2011 |
Structure of trimers of group-2B metal dihalides from relativistic density-functional calculations AS Özen, Z Akdeniz, G Pastore, R Ruberto, MP Tosi Physics and Chemistry of Liquids 53 (1), 1-9, 2015 | 6 | 2015 |
Chemical Reactivity Perspective into the Group 2B Metals Halides AS Özen, Z Akdeniz The Journal of Physical Chemistry A 120 (25), 4401-4407, 2016 | 4 | 2016 |
Structure and bonding in cryolitic melts a combined study by density functional theory and ionic model calculations AS Özen, Z Akdeniz Journal of Molecular Liquids 368, 120771, 2022 | 2 | 2022 |
Dissolution of alumina in cryolite melts: a conceptual DFT study AS Özen, Z Akdeniz Turkish Journal of Physics 46 (6), 228-238, 2022 | 1 | 2022 |
Explosive detection mechanism in silole-and silafluorene containing photoluminescent polymers: a computational approach B Dedeoğlu, AS Özen, L Aviyente ref.[18] 617, 2013 | 1 | 2013 |