| Structural and energetic analysis of copper clusters: MD study of Cu n (n= 2-45) M Böyükata, JC Belchior Journal of the Brazilian Chemical Society 19, 884-893, 2008 | 61 | 2008 |
| Density functional study of AlBn clusters for n= 1–14 M Böyükata, ZB Güvenç Journal of alloys and compounds 509 (11), 4214-4234, 2011 | 45 | 2011 |
| An investigation of hydrogen bonded neutral B4Hn (n= 1–11) and anionic B4H11 (-1) clusters: Density functional study M Böyükata, C Özdoğan, ZB Güvenç Journal of Molecular Structure: THEOCHEM 805 (1-3), 91-100, 2007 | 36 | 2007 |
| Structure and reactivity of Nin (n=7–14, 19) clusters M Böyükata, ZB Güvenç, S Özçelik, P Durmus, J Jellinek International Journal of Quantum Chemistry 84 (2), 208-215, 2001 | 29* | 2001 |
| Size evolution of structures and energetics of iron clusters (Fen, n≤ 36): Molecular dynamics studies using a Lennard–Jones type potential M Böyükata, E Borges, JP Braga, JC Belchior Journal of alloys and compounds 403 (1-2), 349-356, 2005 | 26 | 2005 |
| REACTION DYNAMICS OF Nin (n =19 and 20) WITH D2: DEPENDENCE ON CLUSTER SIZE, TEMPERATURE AND INITIAL ROVIBRATIONAL STATES OF THE … M Böyükata, ZB Güvenç, S Özçeli̇k, P Durmuş, J Jellinek International Journal of Modern Physics C 16 (02), 295-308, 2005 | 24 | 2005 |
| MD study of energetics, melting and isomerization of aluminum microclusters M Böyükata, ZB Güvenç Brazilian journal of physics 36, 720-724, 2006 | 20 | 2006 |
| Vibrational spectroscopic studies of 3-hydroxyphenylboronic acid: molecular structure Y Sert, F Ucun, M Böyükata Indian Journal of Physics 87, 113-119, 2013 | 18 | 2013 |
| DFT study of Al doped cage B12Hn clusters M Böyükata, ZB Güvenç international journal of hydrogen energy 36 (14), 8392-8402, 2011 | 15 | 2011 |
| Reactions of small Ni clusters with a diatomic molecule: MD simulation of D2+ Nin (n= 7–10) systems P Durmuş, M Böyükata, S Özçelik, ZB Güvenç, J Jellinek Surface science 454, 310-315, 2000 | 15 | 2000 |
| Dynamics of the D2 + Ni(100) collision system: Analysis of the reactive and inelastic channels M Böyükata, ZB Güvenç, B Jackson, J Jellinek International Journal of Quantum Chemistry 84 (1), 48-57, 2001 | 14 | 2001 |
| Effects of hydrogen hosting on cage structures of boron clusters: density functional study of BmHn (m= 5–10 and n⩽ m) complexes M Böyükata, C Özdoğan, ZB Güvenç Physica Scripta 77 (2), 025602, 2008 | 13 | 2008 |
| Molecular-dynamics study of possible packing sequence of medium size gold clusters: Au2–Au43 M Böyükata Physica E: Low-dimensional Systems and Nanostructures 33 (1), 182-190, 2006 | 13 | 2006 |
| Conformational and vibrational analysis of 2-, 3-and 4-trifluoromethylbenzaldehyde by ab initio Hartree–Fock, density functional theory and Moller–Plesset pertubasyon theory … Y Sert, F Ucun, M Böyükata Journal of Molecular Structure: THEOCHEM 861 (1-3), 122-130, 2008 | 12 | 2008 |
| Molecular dynamics study of palladium clusters: Size dependent analysis of structural stabilities and energetics of Pdn (n≤ 40) via a Lennard-Jones type potential M Böyükata, JC Belchior Croatica Chemica Acta 81 (2), 289-297, 2008 | 12 | 2008 |
| Molecule–surface interaction: dissociative chemisorption of a D2 (v= 0, j= 0) molecule on rigid low index Ni surfaces M Böyükata, ZB Güvenç Surface science 562 (1-3), 183-194, 2004 | 10 | 2004 |
| FTIR, Raman and DFT studies on 2-[4-(4-ethylbenzamido) phenyl] benzothiazole and 2-[4-(4-nitrobenzamido) phenyl] benzothiazole supported by differential scanning calorimetry O Unsalan, H Arı, C Altunayar-Unsalan, K Bolelli, M Boyukata, I Yalcin Journal of Molecular Structure 1218, 128454, 2020 | 9 | 2020 |
| Structures and energetics of CO2–Arn clusters (n = 1–21) based on a non-rigid potential model M Böyükata, E Borges, JC Belchior, JP Braga Canadian journal of chemistry 85 (1), 47-55, 2007 | 9 | 2007 |
| Micro-Raman, Mid-IR, Far-IR and DFT studies on 2-[4-(4-Fluorobenzamido) phenyl] benzothiazole O Unsalan, Y Sert, H Ari, A Simão, A Yilmaz, M Boyukata, O Bolukbasi, ... Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 125, 414-421, 2014 | 8 | 2014 |
| Hydrogen hosting on nano scale boron clusters M Böyükata, C Özdoğan, ZB Güvenç SCIENCE AND TECHNOLOGY 11 (1), 59-70, 2008 | 8 | 2008 |
Julius JellinekArgonne National LaboratoryVerified email at anl.gov
