Do&#231;. Dr. ETEM K&#214;SE

Journal of Molecular Liquids , cilt.437, 2025 (SCI-Expanded, Scopus)

3. Experimental and computational insights into the electronic structures and absorption-emission characteristics of coumarin, C-6H, C-153, and C-343 dyes

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy , cilt.335, 2025 (SCI-Expanded, Scopus)

4. 2-klorokinolinin Moleküler ve Spektroskopik Özelliklerinin Kuantum Kimyasal Hesaplama Yöntemleriyle Araştırılması

BARDAK F., Kose E.

Afyon Kocatepe Üniversitesi Fen ve Mühendislik Bilimleri Dergisi , cilt.24, sa.3, ss.504-518, 2024 (TRDizin)

5. A comprehensive study on the effect of substitution position and solvent effect on absorption and emission characteristics of n-methylindoles via linear response and State-Specific formalisms

Journal of Photochemistry and Photobiology A: Chemistry , cilt.450, 2024 (SCI-Expanded, Scopus)

6. Experimental and DFT-Based Investigation of Structural, Spectroscopic, and Electronic Features of 6-Chloroquinoline

Kose E., BARDAK F.

Celal Bayar Üniversitesi Fen Bilimleri Dergisi , cilt.19, sa.3, ss.271-281, 2023 (TRDizin)

7. Investigation of the interionic interactions and spectroscopic features of 1-Octyl-3-methylimidazolium chloride, tetrafluoroborate, and hexafluorophosphate ionic liquids: An experimental survey and DFT modeling

Bilgili S., BARDAK F., KÖSE E., ATAÇ A.

Journal of Molecular Structure , cilt.1261, 2022 (SCI-Expanded, Scopus)

8. Anionic dependency of electronic and nonlinear optical properties of ionic liquids

BARDAK F., BARDAK C., KARACA Ç., KÖSE E., Bilgili S., ATAÇ A.

Journal of Molecular Liquids , cilt.345, 2022 (SCI-Expanded, Scopus)

9. Crystal structure, experimental and DFT of (Z)-4-((4-fluorophenyl)amino)pent-3-en-2-one

Jeeva P., Barathi D., Prabakaran K., Seenivasa Perumal M., ATAÇ A., KÖSE E.

Asian Journal of Chemistry , cilt.33, sa.7, ss.1638-1644, 2021 (Scopus)

10. Structural, spectral, experimental, and theoretical investigations of (E)-4-fluoro-N′-(pyridin-2-ylmethylene)benzohydrazide monohydrate

Latha N., Barathi D., Uthaya Kumar M., Vinitha G., Mani R., ATAÇ A., et al.

RESEARCH ON CHEMICAL INTERMEDIATES , cilt.47, sa.6, ss.2469-2486, 2021 (SCI-Expanded, Scopus)

11. The detailed electronic structure, spectroscopic features, and reactivity of dimethylanisoles

KÖSE E.

JOURNAL OF MOLECULAR STRUCTURE , cilt.1227, 2021 (SCI-Expanded, Scopus)

12. Structural, theoretical and third order nonlinear optical properties of (E)-N’-(4-chlorobenzylidene)-4-fluorobenzohydrazide monohydrate

Latha N., Barathi D., Uthaya Kumar M., Vennila K., Vinitha G., Mani R., et al.

Molecular Crystals and Liquid Crystals , cilt.725, sa.1, ss.66-80, 2021 (SCI-Expanded, Scopus)

13. The investigation of fluorine substitution in difluoroanilines with focus on 2,6-difluoroaniline by spectroscopic methods, density functional theory approach, and molecular docking

KÖSE E., BARDAK F., ATAÇ A.

JOURNAL OF MOLECULAR STRUCTURE , cilt.1196, ss.201-214, 2019 (SCI-Expanded, Scopus)

14. The structural and spectroscopic investigation of 2-chloro-3-methylquinoline by DFT method and UV-Vis, NMR and vibrational spectral techniques combined with molecular docking analysis

KÖSE E., ATAÇ A., BARDAK F.

JOURNAL OF MOLECULAR STRUCTURE , cilt.1163, ss.147-160, 2018 (SCI-Expanded, Scopus)

15. Spectral investigations of 2,5-difluoroaniline by using mass, electronic absorption, NMR, and vibrational spectra

KÖSE E., Karabacak M., BARDAK F., ATAÇ A.

JOURNAL OF MOLECULAR STRUCTURE , cilt.1123, ss.284-299, 2016 (SCI-Expanded, Scopus)

16. Conformational, electronic, and spectroscopic characterization of isophthalic acid (monomer and dimer structures) experimentally and by DFT

BARDAK F., KARACA Ç., Bilgili S., ATAÇ A., Mavis T., Asiri A., et al.

SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY , cilt.165, ss.33-46, 2016 (SCI-Expanded, Scopus)

17. The spectroscopic (FT-IR, FT-Raman, dispersive Raman and NMR) study of ethyl-6-chloronicotinate molecule by combined density functional theory

Karabacak M., Calisir Z., Kurt M., KÖSE E., ATAÇ A.

SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY , cilt.153, ss.754-770, 2016 (SCI-Expanded, Scopus)

18. The spectroscopic and quantum chemical studies of 3,4-difluoroaniline

KÖSE E., Karabacak M., ATAÇ A.

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy , cilt.143, ss.265-280, 2015 (SCI-Expanded, Scopus)

19. FT-IR, FT-Raman, NMR and UV-Vis spectra and DFT calculations of 5-bromo-2-ethoxyphenylboronic acid (monomer and dimer structures)

Köse E., Şas E., Kurt M., Karabacak M.

SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY , cilt.137, ss.1315-1333, 2015 (SCI-Expanded, Scopus)

20. DFT calculations and experimental FT-IR, FT-Raman, NMR, UV-Vis spectral studies of 3-fluorophenylboronic acid

Karabacak M., KÖSE E., Sas E., Kurt M., Asiri A., ATAÇ A.

SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY , cilt.136, ss.306-320, 2015 (SCI-Expanded, Scopus)

21. Experimental (FT-IR, FT-Raman, UV-Vis, ¹H and ¹³C NMR) and computational (density functional theory) studies on 3-bromophenylboronic acid

Karabacak M., KÖSE E., ATAÇ A., Sas E., Asiri A., Kurt M.

JOURNAL OF MOLECULAR STRUCTURE , cilt.1076, ss.358-372, 2014 (SCI-Expanded, Scopus)

22. Monomeric and dimeric structures analysis and spectroscopic characterization of 3,5-difluorophenylboronic acid with experimental (FT-IR, FT-Raman, 1H and 13C NMR, UV) techniques and quantum chemical calculations

Karabacak M., KÖSE E., ATAÇ A., Asiri A. M., Kurt M.

Journal of Molecular Structure , cilt.1058, sa.1, ss.79-96, 2014 (SCI-Expanded, Scopus)

23. FT-IR and FT-Raman, NMR and UV spectroscopic investigation and hybrid computational (HF and DFT) analysis on the molecular structure of mesitylene

Köse E., Ataç A., Karabacak M., Nagabalasubramanian P., Asiri A., Periandy S.

SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY , cilt.116, ss.622-634, 2013 (SCI-Expanded, Scopus)

24. Molecular structure investigation and spectroscopic studies on 2,3-difluorophenylboronic acid: A combined experimental and theoretical analysis

Karabacak M., KÖSE E., ATAÇ A., ILGIN M. A., Kurt M.

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy , cilt.97, ss.892-908, 2012 (SCI-Expanded, Scopus)

25. Synthesis, spectroscopic characterization and quantum chemical computational studies of (S)-N-benzyl-1-phenyl-5-(pyridin-2-yl)-pent-4-yn-2- amine

KÖSE E., ATAÇ A., Karabacak M., KARACA Ç., ESKİCİ M., Karanfil A.

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy , cilt.97, ss.435-448, 2012 (SCI-Expanded, Scopus)

26. Synthesis, analysis of spectroscopic and nonlinear optical properties of the novel compound: (S)-N-benzyl-1-phenyl-5-(thiophen-3-yl)-4-pentyn-2-amine

Karabacak M., KARACA Ç., ATAÇ A., ESKİCİ M., Karanfil A., KÖSE E.

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy , cilt.97, ss.556-567, 2012 (SCI-Expanded, Scopus)

27. Molecular structure (monomeric and dimeric structure) and HOMO-LUMO analysis of 2-aminonicotinic acid: A comparison of calculated spectroscopic properties with FT-IR and UV-vis

Karabacak M., KÖSE E., ATAÇ A.

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy , cilt.91, ss.83-96, 2012 (SCI-Expanded, Scopus)

28. Spectroscopic (NMR, UV, FT-IR and FT-Raman) analysis and theoretical investigation of nicotinamide N-oxide with density functional theory

ATAÇ A., Karabacak M., KÖSE E., KARACA Ç.

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy , cilt.83, sa.1, ss.250-258, 2011 (SCI-Expanded, Scopus)

29. FT-Raman, FT-IR spectra and DFT calculations on monomeric and dimeric structures of 5-fluoro- and 5-chloro-salicylic acid

Karabacak M., KÖSE E., Kurt M.

Journal of Raman Spectroscopy , cilt.41, sa.9, ss.1085-1097, 2010 (SCI-Expanded, Scopus)

Hakemli Bilimsel Toplantılarda Yayımlanmış Bildiriler 45

1. Transient Absorption Spectrum Simulation with QM/MM MD methods under Explicit Polar Solvent using the recent COBRAMM scripts

TURKISH PHYSICAL SOCIETY 38th INTERNATIONAL PHYSICS CONGRESS, Muğla, Türkiye, 31 Ağustos 2022, (Özet Bildiri)

2. Static and Dynamic Modeling of N-Methyl-Indole (N=1-6) in Water at the B3LYP/AMBER Level Using the COBRAMM Interface

7. ULUSAL YÜKSEK BAŞARIMLI HESAPLAMA KONFERANSI, İstanbul, Türkiye, 11 - 13 Mayıs 2022, (Özet Bildiri)

3. A Case Study for Exploration of Implicit Solvent Effect by Linear Response and State-Specific Polarizable Continuum Model: Effect of Methyl Substitution in Indole Derivatives on Absorption and Emission Characteristics

Turkish Physical Society 37th International Physics Congress, Bodrum/Muğla, Türkiye, 01 Eylül 2021, (Özet Bildiri)

4. Bazı Chloropyridine Türevlerinin Yapısal ve Spektroskopik Özelliklerinin Kuantum Kimyasal Hesaplamalar Kullanılarak İncelenmesi.

ORAL Y., KÖSE E.

6.Uluslararası Akademik Araştırmalar Kongresi (ICAR), Türkiye, 23 Ağustos 2021, (Özet Bildiri)

5. 4-Kinolinboronik Asidin Yoğunluk Fonksiyonel Teorisi Kullanılarak Konformasyonel ve Spektroskopik Analizi

KÖSE E., BARDAK F., ATAÇ A.

11. Uluslararası Bilimsel Araştırmalar Kongresi, Ankara, Türkiye, 20 Ağustos 2021, (Özet Bildiri)

6. Molecular structural analysis and spectral investigation of 2-chloroethyl benzene

International Congress on the World of Technology and Advanced Materials WITAM-2018, Kırşehir, Türkiye, 21 - 23 Eylül 2018, (Tam Metin Bildiri)

7. Quantum chemical simulations of solvent influence on Absorption and Emission spectra of 9-Bromoanthracene and 9-Bromophenanthrene

International Congress on the World of Technology and Advanced Materials WITAM-2018, Kırşehir, Türkiye, 21 - 23 Eylül 2018, (Özet Bildiri)

8. Linear-Response ve state-specific yaklaşımları kullanılarak mono ve di-metilnaftalen türevlerinin çözelti etkisi altında elektronik geçişleri

Adım Fizik Günleri VII, Aydın, Türkiye, 23 - 25 Mayıs 2018, (Özet Bildiri)

9. UV–VIS and Flouresence Spectroscopy and PCM-DFT/TD-DFT Linear Response, State-Specific study of 1-Bromo-2-Methylnaphthalene and 1-Bromo-4-Bethylnaphthalene

Adım Fizik Günleri VII, Aydın, Türkiye, 23 - 25 Mayıs 2018, (Özet Bildiri)

10. 2,6-Dimethylanisole Molekülünün Yapısal ve Spektroskopik (FT-IR, FT-Raman, NMR, UV-Vis) Özelliklerinin Yoğunluk Fonksiyon Teorisi (YFT) ile İncelenmesi

Adım Fizik Günleri VII, Aydın, Türkiye, 23 - 25 Mayıs 2018, (Özet Bildiri)

11. 2-Chloroquinoline molekülünün yapısal, titreşim, elektronik vekimyasal kayma özelliklerinin Yoğunluk Fonksiyon Teorisi ile (YFT) spektroskopik olarak incelemesi

KÖSE E., KARACA Ç., ATAÇ A., BARDAK F.

Adım Fizik Günleri VII, Aydın, Türkiye, 23 - 25 Mayıs 2018, (Özet Bildiri)

12. Yoğunluk Fonksiyon Teorisi (YFT) Kullanılarak 2,5-Dimethylanisole Molekülünün Yapısal ve Spektroskopik Analizinin Yapılması

Adım Fizik Günleri VII, Türkiye, 23 - 25 Mayıs 2018, (Özet Bildiri)

13. The Structural and Spectroscopic Investigation of 2-Aminobeyzlamine by Using Density Functional Theory and Experimental Techniques

KÖSE E., VANLI M. S., ATAÇ A., BARDAK F.

Turkish Physical Society 33rd International Physics Congress, Bodrum, Türkiye, 6 - 10 Eylül 2017, (Özet Bildiri)

14. Electronic Structure, Absorption And Emission Energy Analysis of Methyldiphenylphosphine Oxide: Under Implicit Solvent Effect by Linear Response and State-Specific PCM–DFT/TD-DFT Method

KARACA Ç., ATAÇ A., BARDAK F., KÖSE E.

Turkish Physical Society 33rd International Physics Congress, Bodrum, Türkiye, 6 - 10 Eylül 2017, (Özet Bildiri)

15. The Experimental And Dft Analysis Of Structural And Spectroscopic Features Of 4-Aminobeyzlamine

VANLI M. S., KÖSE E., ATAÇ A., BARDAK F.

Turkish Physical Society 33rd International Physics Congress, Bodrum, Türkiye, 6 - 10 Eylül 2017, (Özet Bildiri)

16. DFT/TD-DFT Study: Computing Absorption And Fluorescence of Dopamine and Serotonin

Turkish Physical Society 33rd International Physics Congress, Bodrum, 6 - 10 Eylül 2017, (Özet Bildiri)

17. Quantum Mechanical Calculated Reactivity Molecular Docking Features of Difluoroanilines

BARDAK F., KÖSE E., ATAÇ A., KARACA Ç.

3rd International Turkish Congress on Molecular Spectroscopy (TURCMOS2017), Bodrum, Türkiye, 26 - 29 Ağustos 2017, (Özet Bildiri)

18. Molecular, electronic and spectroscopic, properties of 6-Chloroquinoline by using DFT method

KÖSE E., BARDAK F., ATAÇ A., KARACA Ç.

3rd International Turkish Congress on Molecular Spectroscopy (TURCMOS2017), Bodrum, Türkiye, 26 - 29 Ağustos 2017, (Özet Bildiri)

19. Xanthone’un TD-CAM-B3LYP ve State Specific PCM Hesaplamaları

KARACA Ç., ATAÇ A., BARDAK F., KÖSE E.

Adım Fizik Günleri VI, Balıkesir, Türkiye, 19 - 21 Temmuz 2017, (Özet Bildiri)

20. 2,4-dimethylanisole Molekülünün, Titreşim, Kimyasal Kayma Durumları ve Elektronik Özelliklerinin Spektroskopik Olarak İncelenmesi

KÖSE E., ATAÇ A., BARDAK F., KARACA Ç.

Adım Fizik Günleri VI, Balıkesir, Türkiye, 19 - 21 Temmuz 2017, (Özet Bildiri)

21. 2,3-dimethylanisole Molekülüne ait Yapısal, Titreşim, Elektronik ve Kimyasal Kaymaların Spektroskopik İncelemesi

KÖSE E., ATAÇ A., BARDAK F., KARACA Ç.

Adım Fizik Günleri VI, Balıkesir, Türkiye, 19 - 21 Temmuz 2017, (Özet Bildiri)

22. Kuantum Kimyasal Hesaplamalar Kullanarak 2,4 Dibromoacetophenone Molekülünün SpektroskopikAnalizinin Yapılması

KÖSE E.

Adım Fizik Günleri V, Eskişehir, Türkiye, 21 - 23 Nisan 2016, (Özet Bildiri)

23. SINIF YÖNETİMİ DERSİNİN ÖĞRETMEN ADAYLARININ SINIF YÖNETİMİNE YÖNELİK TUTUM VE İNANÇLARINA ETKİSİNİN İNCELENMESİ

ATAÇ A., SELÇUK G., ÇAKMAK C., KÖSE E.

NEW TRENDS IN HIGHER EDUCATION: KEEPING UP WITH THE CHANGE, 12 - 13 Nisan 2016, (Özet Bildiri)

24. Sınıf Yönetimi Dersinin Öğretmen Adaylarının Sınıf Yönetimine Yönelik Tutum ve İnançlarına Etkisinin İncelenmesi

ATAÇ A., SELÇUK G., ÇAKMAK C., KÖSE E.

Yükseköğretimde Yeni Eğilimler: Değişime Ayak Uydurma, 12 - 13 Nisan 2016, (Özet Bildiri)

25. The Quantum Chemical Calculations by Combined Most Common Spectroscopic Techniques for Pentafluoropehol

ATAÇ A., KÖSE E., KARABACAK M.

XIIIth International Conference on Molecular Spectroscopy, Wroclaw, Polonya, 9 - 13 Eylül 2015, (Özet Bildiri)

26. 2,6 difloranilin molekülüne ait spektroskopik ve moleküler yapı analizinin kuantum kimyasal hesaplarla yapılması

Adım Fizik Günleri IV, Kütahya, Türkiye, 28 - 29 Mayıs 2015, (Özet Bildiri)

27. Spectroscopic (FT-IR, FT-Raman, UV, 1H and 13C NMR), Structural, Electronic and Thermodynamical Properties of Isophthalic Acid Experimental and Theoretical Studies Using DFT Calculations

ÇİPİLOĞLU M. A., KÖSE E., YILDIRIM S., ATAÇ A., KARABACAK M.

The 23rd International Conference on High Resolution Molecular Spectroscopy, Bologna, İtalya, 02 Eylül 2014, (Özet Bildiri)

28. The spectroscopic FT IR FT Raman NMR and UV Vis and quantum chemical studies DFT approach of 3 4 difluoroaniline

ATAÇ A., KÖSE E., KARABACAK M., ÇİPİLOĞLU M. A., BİLGİLİ S.

Molecular Modeling in Chemistry and Biochemistry, Cluj, Romanya, 13 - 15 Kasım 2014, (Özet Bildiri)

29. Spectroscopic FT IR FT RAMAN UV 1H and 13C NMR structural electronıc and thermodynamıcal propertıes of isophthalic acid by experimental and theoretical studies using DFT calculations

ÇİPİLOĞLU M. A., KÖSE E., BİLGİLİ S., KARACA Ç., TUĞBA M., ATAÇ A.

The 23rd International Conference on High Resolution Molecular Spectroscopy, Bologna, İtalya, 2 - 06 Eylül 2014, (Özet Bildiri)

30. Spectroscopıc FT IR FT RAMAN UV 1H and 13C NMR structural electronıc and thermodynamıcal propertıes of ısophthalıc acıd by experımental and theoretıcal studıes usıng DFT calculatıons

ÇİPİLOĞLU M. A., KÖSE E., BİLGİLİ S., KARACA Ç., TUĞBA M., ATAÇ A., et al.

The 23rd International Conference on High Resolution Molecular Spectroscopy, Bologna, İtalya, 2 - 06 Eylül 2014, (Özet Bildiri)

31. Molecular Structure, Electronic Properties, NBO Analysis And Spectroscopic Characterization Of 4-fluorophenyl)(4-hydroxy-3-methylphenyl)methanone Using Quantum Chemical Calculations

KARABACAK M., KARACA Ç., ATAÇ A., KÖSE E.

Uluslararası Katılımlı 4. Ulusal Kristalografi Toplantisi, Diyarbakır, Türkiye, 17 - 19 Mayıs 2014, (Özet Bildiri)

32. DFT Study and Conformational Analysisof 2-(2-fluoro-4-nitrophenoxy)-3-nitropyridine

KARABACAK M., KARACA Ç., ATAÇ A., KÖSE E.

Uluslararası Katılımlı 4. Ulusal Kristalografi Toplantisi, Diyarbakır, Türkiye, 17 - 19 Mayıs 2014, (Özet Bildiri)

33. Experimental FT IR FT RAMAN UV 1H and 13C NMR and Computational Density Functional Theory studies on 3 bromophenylboronic acid

ATAÇ A., KÖSE E., KARABACAK M., KURT M.

International Turkish Congress on Molecular Spectroscopy, İstanbul, Türkiye, 15 - 20 Eylül 2013, (Özet Bildiri)

34. Structural and Spectroscopıc Propertıes of 3 fluorophenylboronıc acıd on Experımental and Theoretıcal Approach

ATAÇ A., KARABACAK M., KÖSE E., KURT M.

XIIth International Conference on Molecular Spectroscopy, Krakow, Polonya, 8 - 12 Eylül 2013

35. The Structural and Spectroscopic Characterization of 3 Methyl 1 Phenylpyrazole using Density Functional Theory Comparing and Experimental Techniques NMR FT IR and FT Raman

30th International Physics Congress, İstanbul, Türkiye, 2 - 05 Eylül 2013, (Özet Bildiri)

36. Quantum chemical study on 1 Methyl 3 phenylpropylamine with combined an experimental NMR FT IR and FT Raman The structural and spectroscopic characterization

29th International Physics Congress, BODRUM, Türkiye, 5 - 08 Eylül 2012, (Özet Bildiri)

37. Molecular structure NMR infrared spectra HOMO LUMO analysis of 2 fluoro 4 hydroxybenzonitrile

8th Nanoscience and Nanotechnology Congress, Ankara, Türkiye, 25 - 29 Haziran 2012, (Özet Bildiri)

38. Molecular Structure NMR Infrared and Raman Spectra HOMO LUMO analysis of p tolylacetonitrile