DFT study of Al doped cage B12Hn clusters
BÖYÜKATA, Mustafa, GÜVENC, Ziya B
Published in International journal of hydrogen energy (01.07.2011)
Published in International journal of hydrogen energy (01.07.2011)
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Journal Article
Ab Initio Hartree-Fock and Density Functional Theory Study on Molecular Structures, Energies, and Vibrational Frequencies of 2-Amino-3-, 4-, and 5-Nitropyridine
Sert, Yusuf, Ucun, Fatih, Böyükata, Mustafa
Published in Zeitschrift für Naturforschung. A, A journal of physical sciences (01.01.2010)
Published in Zeitschrift für Naturforschung. A, A journal of physical sciences (01.01.2010)
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Journal Article
Estimation of cross sections for molecule-cluster interactions by using artificial neural networks
Böyükata, Mustafa, Koçyigit, Yücel, Güvenç, Ziya B.
Published in Brazilian journal of physics (01.09.2006)
Published in Brazilian journal of physics (01.09.2006)
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Journal Article
Conformational and vibrational analysis of 2-, 3- and 4-trifluoromethylbenzaldehyde by ab initio Hartree–Fock, density functional theory and Moller–Plesset pertubasyon theory calculations
Sert, Yusuf, Ucun, Fatih, Böyükata, Mustafa
Published in Journal of molecular structure. Theochem (30.07.2008)
Published in Journal of molecular structure. Theochem (30.07.2008)
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Journal Article
D2 +Nin(T), n=7 and 9, Collision System
Böyükata, Mustafa, Durmuş, Perihan, Özçelik, Süleyman, Güvenç, Ziya, Jellinek, Julius
Published in Mathematical and computational applications (01.04.1999)
Published in Mathematical and computational applications (01.04.1999)
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Journal Article
Synthesis and DFT study of Cd(II) and Hg(II) complexes of ONNO-type Schiff bases
Aksu, Mecit, Çifci, Mehmet, Böyükata, Mustafa, Durmuş, Sefa, Babgi, Bandar
Published in Inorganic and nano-metal chemistry (03.06.2017)
Published in Inorganic and nano-metal chemistry (03.06.2017)
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Journal Article
FTIR, Raman and DFT studies on 2-[4-(4-ethylbenzamido)phenyl]benzothiazole and 2-[4-(4-nitrobenzamido)phenyl]benzothiazole supported by differential scanning calorimetry
Unsalan, Ozan, Arı, Hatice, Altunayar-Unsalan, Cisem, Bolelli, Kayhan, Boyukata, Mustafa, Yalcin, Ismail
Published in Journal of molecular structure (15.10.2020)
Published in Journal of molecular structure (15.10.2020)
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