Crystal structure and Hirshfeld surface analysis of 2-methyl-3-nitro- N -[( E )-(5-nitro-thio-phen-2-yl)methyl-idene]aniline
Kansiz, Sevgi, Dege, Necmi, Ozturk, Seyhan, Akdemir, Nesuhi, Tarcan, Erdoğan, Arslanhan, Ali, Saif, Eiad
Published in Acta crystallographica. Section E, Crystallographic communications (01.02.2021)
Published in Acta crystallographica. Section E, Crystallographic communications (01.02.2021)
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A theoretical investigation on hirshfeld surface, IR., UV–Vis, 1H and 13C NMR spectra, nonlinear optical properties, and in silico molecular docking of an organometallic compound: Dibromobis(l-proline)zinc(II)
Zohra Boudjenane, Fatima, Douaa Benyahlou, Zohra, Hadj Mortada Belhachemi, Mohammed, Boukabcha, Nourdine, Tamer, Ömer, Yahiaoui, Salem, Atalay, Yusuf, Tarcan, Erdoğan, Chouaih, Abdelkader
Published in Computational and theoretical chemistry (01.11.2023)
Published in Computational and theoretical chemistry (01.11.2023)
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A Theoretical Study on Structural, Spectroscopic, Electronic and Nonlinear Optical Properties of 1-[(E)-{[4-(Morpholin-4-Yl)Phenyl]Imino}Methyl]Naphthalen-2-Ol
Gümüş, Hacer Pir, Tamer, Ömer, Avcı, Davut, Atalay, Yusuf, Tarcan, Erdoğan
Published in Brazilian journal of physics (01.10.2016)
Published in Brazilian journal of physics (01.10.2016)
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Optimized geometry, vibration (IR and Raman) spectra and nonlinear optical activity of p-nitroanilinium perchlorate molecule: A theoretical study
Tamer, Ömer, Sefa Atalay, Ahmet, Avci, Davut, Atalay, Yusuf, Tarcan, Erdoğan, Marchewka, Mariusz K.
Published in Materials science--Poland (01.03.2016)
Published in Materials science--Poland (01.03.2016)
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Molecular structure and vibrational assignment of melaminium phthalate by density functional theory (DFT) and ab initio Hartree-Fock (HF) calculations
Tarcan, Erdoğan, Altındağ, Özgü, Avcı, Davut, Atalay, Yusuf
Published in Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy (01.11.2008)
Published in Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy (01.11.2008)
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Crystal structure and Hirshfeld surface analysis of 2-methyl-3-nitro-N-(E)-(5-nitro-thio-phen-2-yl)methyl-ideneaniline
Kansiz, Sevgi, Dege, Necmi, Ozturk, Seyhan, Akdemir, Nesuhi, Tarcan, Erdoğan, Arslanhan, Ali, Saif, Eiad
Published in Acta crystallographica. Section E, Crystallographic communications (01.02.2021)
Published in Acta crystallographica. Section E, Crystallographic communications (01.02.2021)
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Quantum chemical computational studies on bis-thiourea zinc acetate
Pir, Hacer, Günay, Nergin, Tamer, Ömer, Avci, Davut, Tarcan, Erdoğan, Atalay, Yusuf
Published in Materials science--Poland (01.08.2013)
Published in Materials science--Poland (01.08.2013)
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Improvement of reference gas calorimeter to measure the gross calorific value of the reference methane gas having high purity (99.995 %) and calculation of uncertainty
Ozcan, Kemal, Canel, Timur, Tarcan, Erdogan
Published in Accreditation and quality assurance (01.04.2022)
Published in Accreditation and quality assurance (01.04.2022)
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Theoretical investigations on nonlinear optical and spectroscopic properties of 6-(3,3,4,4,4-pentafluoro-2-hydroxy-1-butenyl)-2,4-pyrimidinedione: An efficient NLO material
Gümüs, Hacer Pir, Tamer, Ömer, Avci, Davut, Tarcan, Erdogan, Atalay, Yusuf
Published in Russian Journal of Physical Chemistry A (01.12.2014)
Published in Russian Journal of Physical Chemistry A (01.12.2014)
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Molecular Structure, Vibrational Spectra and Chemical Shift Properties of C12H9ClO4 and C12H9BrO4 Crystals by Density Functional Theory and ab initio Hartree-Fock Calculations
Günay, Nergin, Tarcan, Erdogan, Avcı, Davut, Esmer, Kadir, Atalay, Yusuf
Published in Zeitschrift für Naturforschung. A, A journal of physical sciences (01.11.2009)
Published in Zeitschrift für Naturforschung. A, A journal of physical sciences (01.11.2009)
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Molecular Structure, Vibrational Spectra and Chemical Shift Properties of C 12 H 9 ClO 4 and C 12 H 9 BrO 4 Crystals by Density Functional Theory and ab initio Hartree-Fock Calculations
Günay, Nergin, Tarcan, Erdogan, Avcı, Davut, Esmer, Kadir, Atalay, Yusuf
Published in Zeitschrift für Naturforschung. A, A journal of physical sciences (01.11.2009)
Published in Zeitschrift für Naturforschung. A, A journal of physical sciences (01.11.2009)
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