| Spectroscopic and DFT studies of flurbiprofen as dimer and its Cu (II) and Hg (II) complexes S Sagdinc, H Pir Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 73 (1 …, 2009 | 136 | 2009 |
| Theoretical investigation of 5-(2-Acetoxyethyl)-6-methylpyrimidin-2, 4-dione: Conformational study, NBO and NLO analysis, molecular structure and NMR spectra H Pir, N Günay, Ö Tamer, D Avcı, Y Atalay Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 112, 331-342, 2013 | 75 | 2013 |
| NLO and NBO Analysis of Sarcosine‐Maleic Acid by Using HF and B3LYP Calculations N Günay, H Pir, D Avcı, Y Atalay Journal of Chemistry 2013 (1), 712130, 2013 | 51 | 2013 |
| Molecular structure, vibrational spectra, NLO and NBO analysis of bis (8-oxy-1-methylquinolinium) hydroiodide H Pir, N Günay, D Avcı, Y Atalay Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 96, 916-924, 2012 | 50 | 2012 |
| Quantum chemical calculations on the geometrical, conformational, spectroscopic and nonlinear optical parameters of 5-(2-Chloroethyl)-2, 4-dichloro-6-methylpyrimidine HP Gümüş, Ö Tamer, D Avcı, Y Atalay Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 129, 219-226, 2014 | 41 | 2014 |
| Effects of donor–acceptor groups on the structural and electronic properties of 4-(methoxymethyl)-6-methyl-5-nitro-2-oxo-1, 2-dihydropyridine-3-carbonitrile HP Gümüş, Ö Tamer, D Avcı, Y Atalay Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 132, 183-190, 2014 | 32 | 2014 |
| L-asparaginyum pikrat molekülünün spektroskopik özelliklerinin teorik olarak incelenmesi N Günay, H Pir, Y Atalay Sakarya Üniversitesi Fen Edebiyat Fakültesi, 2011 | 21 | 2011 |
| Quantum chemical computational studies on bisthiourea zinc chloride H Pir, N Günay, D Avcı, Y Atalay Indian Journal of Physics 86, 1049-1063, 2012 | 17 | 2012 |
| Study of the solvent effects on the molecular structure and CO stretching vibrations of flurbiprofen N Tekin, H Pir, S Sagdinc Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 98, 122-131, 2012 | 16 | 2012 |
| Quantum chemical computational studies on bis-thiourea zinc acetate H Pir, N Günay, Ö Tamer, D Avci, E Tarcan, Y Atalay Materials Science-Poland 31, 357-371, 2013 | 14 | 2013 |
| 4-(Metoksimetil)-1, 6-dimetil-2-okso-1, 2-dihidropiridin-3-karbonitril molekülünün teorik olarak incelenmesi HP Gümüş, Ö Tamer, D Avcı, Y Atalay Sakarya University Journal of Science 19 (3), 303-311, 2015 | 13 | 2015 |
| 3-hidroksi-4-hidroksimiinometil-5-hidroksimetil-1, 2-dimetilpiridinyum iyodid molekülünün geometrik yapısının incelenmesi HP Gümüş, Y Atalay Sakarya Üniversitesi Fen Bilimleri Enstitüsü Dergisi 21 (3), 564-571, 2017 | 7 | 2017 |
| Density functional theory calculations on conformational, spectroscopic and electrical properties of 3-(2, 3-dimethoxyphenyl)-1-(pyridin-2-yl) prop-2-en-1-one: a potential … H Pir Gümüş, Ö Tamer, D Avcı, Y Atalay Indian Journal of Physics 90, 79-89, 2016 | 7 | 2016 |
| 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 HP Gümüs, Ö Tamer, D Avci, E Tarcan, Y Atalay Russian Journal of Physical Chemistry A 88, 2348-2358, 2014 | 7 | 2014 |
| DFT and Molecular Docking Study of 1-(2-Thiophen)-2-propen-1-one-3-(2, 3, 5-trichlorophenyl)(TTCP) Molecule as Antiviral to Covid-19 Main Protease C Ipek, H Gümüş, M Şimşek, M Tosun Arabian Journal for Science and Engineering 48 (1), 1031-1040, 2023 | 5 | 2023 |
| Theoretical Investigation of 6-(3, 3, 4, 4, 4-Pentafluoro-2-Hydroxy-1-Butenyl)-2, 4-Dimethoxy-Pyrimidine Molecule H Pir, N Günay, D Avcı, Ö Tamer, E Tarcan, Y Atalay Arabian Journal for Science and Engineering 39, 5799-5814, 2014 | 4 | 2014 |
| Spectroscopic (Vibrational and NMR) Characterizations and Molecular Docking Analysis of Zn (II), Cd (II) and Hg (II) Complexes with Alkyl–Aryl Dithiocarbamates H Gümüş Arabian Journal for Science and Engineering 45 (6), 4929-4937, 2020 | 3 | 2020 |
| A Theoretical Study on Structural, Spectroscopic, Electronic and Nonlinear Optical Properties of 1-[(E)-{[4-(Morpholin-4-Yl) Phenyl] Imino} Methyl] Naphthalen-2-Ol HP Gümüş, Ö Tamer, D Avcı, Y Atalay, E Tarcan Brazilian Journal of Physics 46, 471-480, 2016 | 3 | 2016 |
| Conformational, spectroscopic, electric and electronic investigations on 5-nitropyridine-2-hydrazino-3-carbonitrile-6-methyl-4-(methoxymethyl)(molecule 2): molecular docking study HP Gümüş Journal of Molecular Structure 1211, 128018, 2020 | 2 | 2020 |
| Nikotinamid içeren Çinko (II) kompleksinin moleküler özellikleri ve titreşim spektrumu H Gümüş Gümüşhane Üniversitesi Fen Bilimleri Dergisi 9 (2), 254-261, 2019 | 2 | 2019 |
