Publications & Works

Publication Network
Articles 81
All (81)
SCI-E, SSCI, AHCI (74)
SCI-E, SSCI, AHCI, ESCI (75)
ESCI (1)
Scopus (75)
TRDizin (3)
Other Publications (4)

1. Accelerating density of states prediction in Zn-doped MgO nanoparticles via kernel-optimized weighted k-NN

Kurban H., Sharma P., Dalkilic M. M., KURBAN M.
Scientific Reports , vol.15, no.1, 2025 (SCI-Expanded, Scopus) identifier identifier

2. Sustainable design of green-functionalized -conjugated BTBF-DPA derivatives for high-mobility hole transport

Shariatinia Z., Kurban M.
TETRAHEDRON , vol.188, pp.1-10, 2025 (SCI-Expanded, Scopus) Sustainable Development identifier

3. Asymmetric anthracene derivatives as electron transport materials for high performance OLEDs

KURBAN M., Shariatinia Z.
Journal of Photochemistry and Photobiology A: Chemistry , vol.468, 2025 (SCI-Expanded, Scopus) identifier

4. A Novel Pyridopyrimidine Derivative as a Potential Breast Cancer Agent: DFT, Docking, MD Simulation, and Cytotoxic Studies

Maurya A., Al-Wahaibi L. H., Pal M., Shukla R., Siddiqui Z., Pathak S. K., et al.
CHEMISTRY & BIODIVERSITY , 2025 (SCI-Expanded, Scopus) identifier identifier identifier

5. Systematic evaluation and rational design of metalloporphyrin-based humidity sensors: Effects of central metal, solvent, and water coordination

Özdemir B., Hayber Ş. E., Kurban M.
JOURNAL OF MOLECULAR LIQUIDS , vol.437, no.C, pp.1-17, 2025 (SCI-Expanded, Scopus) Creative Commons License

6. CrysMTM: a multiphase, temperature-resolved, multimodal dataset for crystalline materials

Polat C., Serpedin E., KURBAN M., Kurban H.
MACHINE LEARNING-SCIENCE AND TECHNOLOGY , vol.6, no.3, 2025 (SCI-Expanded, Scopus) identifier identifier

7. Enabling ease of access to quantum chemistry with transformer-based text encoding and physics-informed multilayer perceptron

Polat C., Kurban H., KURBAN M.
PHYSICA SCRIPTA , vol.100, no.8, 2025 (SCI-Expanded, Scopus) identifier identifier

8. Eco-friendly layered carbide synthesis from renewable precursors for energy storage applications

Coley W., Akhavi A., Pena P., Shang R., Ma Y., August-Hernandez A., et al.
iScience , vol.28, no.6, 2025 (SCI-Expanded, Scopus) identifier identifier identifier

9. Drug delivery potential of γ-graphyne, 6,6,12-graphyne and γ-graphdiyne for 5-Fluorouracil: insights from DFT calculations

Maurya A., Mishra A. N., Srivastava J., Mishra S., Pal M., Shukla R., et al.
COMPOSITE INTERFACES , 2025 (SCI-Expanded, Scopus) identifier

10. QUANTUMSHELLNET: : Ground-state eigenvalue prediction of materials using electronic shell structures and fermionic properties via convolutions

Polat C., Kurban H., KURBAN M.
COMPUTATIONAL MATERIALS SCIENCE , vol.246, 2025 (SCI-Expanded, Scopus) identifier identifier

11. Multimodal neural network-based predictive modeling of nanoparticle properties from pure compounds

Polat C., KURBAN M., Kurban H.
MACHINE LEARNING-SCIENCE AND TECHNOLOGY , vol.5, no.4, 2024 (SCI-Expanded, Scopus) identifier identifier

12. Computational study of new small molecules D-A based on triphenylamines for bulk heterojunction solar cells (BHJ)

Mouhi R. E., Slimi A., Khattabi S. E., Benjelloun A. T., Fitri A., Benzakour M., et al.
Computational and Theoretical Chemistry , vol.1241, 2024 (SCI-Expanded, Scopus) identifier

13. Elucidating roles of fulleropyrrolidine-based materials as extraordinary electron transporters for boosting efficiency of perovskite photovoltaics

Kurban M., Shariatinia Z.
JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS , vol.194, pp.112220, 2024 (SCI-Expanded, Scopus) Sustainable Development

14. Drug delivery potential of carbon and boron nitride nanotubes: A DFT-D3 analysis of curcumin binding interactions

Bechohra L. L., KURBAN M., Medigue N. E. H., Kellou-Taïri S.
Diamond and Related Materials , vol.149, 2024 (SCI-Expanded, Scopus) identifier

15. Enhancing the electronic properties of TiO2 nanoparticles through carbon doping: An integrated DFTB and computer vision approach

KURBAN M., Polat C., Serpedin E., Kurban H.
Computational Materials Science , vol.244, 2024 (SCI-Expanded, Scopus) identifier

16. Rational and green functionalization of B,N-C60 by DNA bases devised as incredible electron transport compounds for perovskite photovoltaic devices

Shariatinia Z., KURBAN M.
Materials Today Communications , vol.39, 2024 (SCI-Expanded, Scopus) identifier

17. Computational analysis and experimental validation of a quinoline derivative for optoelectronic and pharmacological applications

KURBAN M., Sertbakan T. R., Muz I.
MATERIALS TODAY COMMUNICATIONS , vol.39, 2024 (SCI-Expanded, Scopus) Creative Commons License identifier identifier

18. Investigating the effect of Zn doping and temperature on the photoluminescence behaviour of CuLaSe2 quantum dots

Çadırcı M., Elibol E., Demirci T., KURBAN M.
Luminescence , vol.39, no.4, 2024 (SCI-Expanded, Scopus) identifier identifier

19. Rational design of SnO2 thin film coated cathode with function of entrapping polysulfides for performance enhanced Li–S batteries

Shang R., KURBAN M., ma Y., Ozkan M., Ozkan C. S.
Journal of Power Sources , vol.597, 2024 (SCI-Expanded, Scopus) identifier

20. Investigating the potential use of (ZnO)60 nanoparticle as drug delivery system for chloroquine, hydroxychloroquine, favipiravir, and remdesivir

KURBAN M., Muz I.
MATERIALS TODAY COMMUNICATIONS , vol.38, 2024 (SCI-Expanded, Scopus) Creative Commons License Sustainable Development identifier identifier

21. Chelant-enhanced solution for wafer-scale synthesis of few-layer WS2 films

Isarraraz M., Pena P., Sayyad M., Yang S., Li H., Akhavi A., et al.
MRS BULLETIN , vol.48, no.10, pp.1073-1085, 2023 (SCI-Expanded, Scopus) Sustainable Development identifier identifier

22. Size-dependent adsorption performance of ZnO nanoclusters for drug delivery applications

Kurban M., Muz I.
STRUCTURAL CHEMISTRY , vol.34, no.3, pp.1061-1071, 2023 (SCI-Expanded, Scopus) Creative Commons License Sustainable Development identifier identifier identifier

23. Sulfur doping concentration effect on the electronic and structural properties of ZnO nanoparticles: Insights from DFTB calculations

Kurban M.
COMPUTATIONAL AND THEORETICAL CHEMISTRY , vol.1224, 2023 (SCI-Expanded, Scopus) identifier identifier

24. Superporous nanocarbon materials upcycled from polyethylene terephthalate waste for scalable energy storage

Mirjalili A., Dong B., Zerrin T., Akhavi A., Kurban M., Ozkan C. S., et al.
JOURNAL OF ENERGY STORAGE , vol.58, 2023 (SCI-Expanded, Scopus) Sustainable Development identifier identifier

25. A strategy to enhance V-OC of pi-conjugated molecules based on thieno[2,3-b] indole for applications in bulk heterojunction organic solar cells using DFT, TD-DFT, and 3D-QSPR modeling studies

El Mouhi R., Daoui O., Fitri A., Benjelloun A. T., El Khattabi S., Benzakour M., et al.
NEW JOURNAL OF CHEMISTRY , vol.47, no.2, pp.812-827, 2023 (SCI-Expanded, Scopus) Sustainable Development identifier identifier

26. Zinc oxide nanoclusters and their potential application as CH4 and CO2 gas sensors: Insight from DFT and TD-DFT

Muz I., Kurban M.
JOURNAL OF COMPUTATIONAL CHEMISTRY , vol.43, no.27, pp.1839-1847, 2022 (SCI-Expanded, Scopus) Sustainable Development identifier identifier identifier

27. Rapidly predicting Kohn-Sham total energy using data-centric AI

Kurban H., Kurban M., Dalkilic M. M.
SCIENTIFIC REPORTS , vol.12, no.1, 2022 (SCI-Expanded, Scopus) Creative Commons License Sustainable Development identifier identifier identifier

28. DFT, DFTB and TD-DFT theoretical investigations of p-conjugated molecules based on thieno[2,3-b] indole for dye-sensitized solar cell applications

El Mouhi R., Slimi A., Fitri A., Benjelloun A. T., ElKhattabi S., Benzakour M., et al.
PHYSICA B-CONDENSED MATTER , vol.636, 2022 (SCI-Expanded, Scopus) identifier identifier

29. A density functional theory study on favipiravir drug interaction with BN-doped C60 heterofullerene

Muz I., GÖKTAŞ F., Kurban M.
PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES , vol.135, 2022 (SCI-Expanded, Scopus) identifier identifier

30. A first-principles evaluation on the interaction of 1,3,4-oxadiazole with pristine and B-, Al-, Ga-doped C-60 fullerenes

Muz I., Kurban M.
JOURNAL OF MOLECULAR LIQUIDS , vol.335, 2021 (SCI-Expanded, Scopus) identifier identifier

31. Building Machine Learning systems for multi-atoms structures: CH3NH3PbI3 perovskite nanoparticles

Kurban H., Kurban M.
COMPUTATIONAL MATERIALS SCIENCE , vol.195, 2021 (SCI-Expanded, Scopus) identifier identifier

32. Sensing capability and diameter-dependent electronic structure of boron nitride nanotubes

Muz I., Alaei S., Kurban M.
MATERIALS TODAY COMMUNICATIONS , vol.27, 2021 (SCI-Expanded, Scopus) identifier identifier

33. Rare-class learning over Mg-doped ZnO nanoparticles

Kurban H., Kurban M.
CHEMICAL PHYSICS , vol.546, 2021 (SCI-Expanded, Scopus) identifier identifier

34. Effect of Mg content on electronic structure, optical and structural properties of amorphous ZnO nanoparticles: A DFTB study

Kurban H., Alaei S., Kurban M.
JOURNAL OF NON-CRYSTALLINE SOLIDS , vol.560, 2021 (SCI-Expanded, Scopus) identifier identifier

35. A DFT study on stability and electronic structure of AlN nanotubes

Muz I., Kurban H., Kurban M.
MATERIALS TODAY COMMUNICATIONS , vol.26, 2021 (SCI-Expanded, Scopus) identifier identifier

36. Single- and multi-layer arsenene as an anode material for Li, Na, and K-ion battery applications

Kanli M., Kurban M., Ozdemir B., Onen A., Durgun E.
COMPUTATIONAL MATERIALS SCIENCE , vol.186, 2021 (SCI-Expanded, Scopus) identifier identifier

37. Electronic structures and bonding of graphdiyne and its BN analogs: Transition from quasi-planar to planar sheets

Muz I., Kurban M.
JOURNAL OF ALLOYS AND COMPOUNDS , vol.846, 2020 (SCI-Expanded, Scopus) identifier identifier

38. Size dependence in the electronic and optical properties of a BN analogue of two-dimensional graphdiyne: A theoretical study

Muz I., Goktaa F., Kurban M.
CHEMICAL PHYSICS , vol.539, 2020 (SCI-Expanded, Scopus) identifier identifier

39. The electronic structure, transport and structural properties of nitrogen-decorated graphdiyne nanomaterials

Muz I., Kurban M.
JOURNAL OF ALLOYS AND COMPOUNDS , vol.842, 2020 (SCI-Expanded, Scopus) identifier identifier

40. Tailoring the structural properties and electronic structure of anatase, brookite and rutile phase TiO2 nanoparticles: DFTB calculations

Kurban H., Dalkilic M., TEMİZ S., Kurban M.
COMPUTATIONAL MATERIALS SCIENCE , vol.183, 2020 (SCI-Expanded, Scopus) identifier identifier

41. DFT and TD-DFT studies of new pentacene-based organic molecules as a donor material for bulk-heterojunction solar cells

Muz I., Kurban M., Dalkilic M.
JOURNAL OF COMPUTATIONAL ELECTRONICS , vol.19, no.3, pp.895-904, 2020 (SCI-Expanded, Scopus) identifier identifier

42. Theoretical investigation of the adsorption behaviors of fluorouracil as an anticancer drug on pristine and B-, Al-, Ga-doped C36 nanotube

Kurban M., Muz I.
JOURNAL OF MOLECULAR LIQUIDS , vol.309, 2020 (SCI-Expanded, Scopus) identifier identifier

43. A combined experimental and DFT/TD-DFT studies on the electronic structure, structural and optical properties of quinoline derivatives

Kurban M., Sertbakan T. R., Gunduz B.
JOURNAL OF MOLECULAR MODELING , vol.26, no.6, 2020 (SCI-Expanded, Scopus) identifier identifier identifier

44. Evaluation of electronic transport and optical response of two-dimensional Fe-doped TiO2 thin films for photodetector applications

Kara F., Kurban M., Coskun B.
OPTIK , vol.210, 2020 (SCI-Expanded, Scopus) identifier identifier

45. Electronic Transport and Non-linear Optical Properties of Hexathiopentacene (HTP) Nanorings: A DFT Study

Muz I., Kurban M.
JOURNAL OF ELECTRONIC MATERIALS , vol.49, no.5, pp.3282-3289, 2020 (SCI-Expanded, Scopus) identifier identifier

46. 3d-transition metals (Cu, Fe, Mn, Ni, V and Zn)-doped pentacene pi-conjugated organic molecule for photovoltaic applications: DFT and TD-DFT calculations

Muz I., GÖKTAŞ F., Kurban M.
THEORETICAL CHEMISTRY ACCOUNTS , vol.139, no.2, 2020 (SCI-Expanded, Scopus) identifier identifier

47. Suppression of the Shuttle Effect in Li-S Batteries via Magnetron Sputtered TiO2 Thin Film at the Electrode-Electrolyte Interface

Zerrin T., Kurban M., Dickson M. M., Ozkan M., Ozkan C. S.
ACS APPLIED ENERGY MATERIALS , vol.3, no.2, pp.1515-1529, 2020 (SCI-Expanded, Scopus) Sustainable Development identifier identifier

48. The effects of a single atom substitution and temperature on electronic and photophysical properties F8T2 organic material

KURBAN M.
Bilge International Journal of Science and Technology Research , vol.3, pp.40-44, 2019 (Peer-Reviewed Journal)

49. Density-functional tight-binding approach for the structural analysis and electronic structure of copper hydride metallic nanoparticles

Kurban H., Kurban M., Dalkilic M.
MATERIALS TODAY COMMUNICATIONS , vol.21, 2019 (SCI-Expanded, Scopus) identifier identifier

50. Molecular dynamics study on composition and temperature dependences of mechanical properties of CdTeSe nanowires under uniaxial stretching

Koyluoglu B., Alaei S., Kurban M.
INTERNATIONAL JOURNAL OF MODERN PHYSICS B , vol.33, no.31, 2019 (SCI-Expanded, Scopus) identifier identifier

51. Controlling structural and electronic properties of ZnO NPs: Density-functional tight-binding method

KURBAN M., KURBAN H., Dalkılıç M.
Bilge International Journal of Science and Technology Research , vol.3, pp.35-39, 2019 (Peer-Reviewed Journal)

52. A comprehensive study on electronic structure and optical properties of carbon nanotubes with doped B, Al, Ga, Si, Ge, N, P and As and different diameters

Muz I., Kurban M.
JOURNAL OF ALLOYS AND COMPOUNDS , vol.802, pp.25-35, 2019 (SCI-Expanded, Scopus) identifier identifier

53. A study of structural phase transitions and optoelectronic properties of perovskite-type hydride MgFeH3: ab initio calculations

Kurban M., Kurkcu C., Yamcicier C., GÖKTAŞ F.
JOURNAL OF PHYSICS-CONDENSED MATTER , vol.31, no.30, 2019 (SCI-Expanded, Scopus) identifier identifier identifier

54. Enhancement of electronic, photophysical and optical properties of 5,5 '-Dibromo-2,2 '-bithiophene molecule: new aspect to molecular design

Muz I., Kurban M.
OPTO-ELECTRONICS REVIEW , vol.27, no.2, pp.113-118, 2019 (SCI-Expanded, Scopus) identifier identifier

55. Tunable electronic structure and structural transition of GaAs clusters at high pressure and temperature

Kurban M.
JOURNAL OF ALLOYS AND COMPOUNDS , vol.791, pp.1159-1166, 2019 (SCI-Expanded, Scopus) identifier identifier

56. Study of Structural and Optoelectronic Properties of Hexagonal ZnO Nanoparticles

KURBAN H., Kurban M.
Bilecik Şeyh Edebali Üniversitesi Fen Bilimleri Dergisi , vol.6, no.2, pp.243-250, 2019 (TRDizin) identifier

57. Structural evolution and electronic properties of CaS: An ab initio study

Kurkcu C., Yamcicier C., Kurban M.
SOLID STATE SCIENCES , vol.90, pp.14-20, 2019 (SCI-Expanded, Scopus) identifier identifier

58. Experimental and theoretical studies of the structural, electronic and optical properties of BCzVB organic material

Kurban M., Gunduz B., GÖKTAŞ F.
OPTIK , vol.182, pp.611-617, 2019 (SCI-Expanded, Scopus) identifier identifier

59. Photophysical, spectroscopic properties and electronic structure of BND: Experiment and theory

Sas E. B., Kurban M., Gunduz B., Kurt M.
SYNTHETIC METALS , vol.246, pp.39-44, 2018 (SCI-Expanded, Scopus) identifier identifier

60. MOLECULAR DYNAMICS STUDY ON THE STRUCTURAL, THERMAL AND ENERGETIC PROPERTIES OF GaAs NANOPARTICLES

KURBAN M.
Eskişehir Technical University Journal of Science and and Technology A- Applied Sciences and Engineering , vol.19, no.3, pp.620-627, 2018 (TRDizin) identifier

61. Photophysical and optical properties of 5-Bromo-2-nitropyridine organic molecule: Experiment and theory

Gunduz B., Kurban M.
OPTICAL MATERIALS , vol.85, pp.373-381, 2018 (SCI-Expanded, Scopus) identifier identifier

62. Electronic structure, elastic and phonon properties of perovskite-type hydrides MgXH3 (X = Fe, Co) for hydrogen storage

Candan A., Kurban M.
SOLID STATE COMMUNICATIONS , vol.281, pp.38-43, 2018 (SCI-Expanded, Scopus) identifier identifier

63. Investigation of Structural, Vibrational Properties and Electronic Structure of Fluorene-9-Bisphenol: A DFT Approach

Kotiloglu S. O., Celik S., Tanis E., Kurban M.
CHEMISTRYSELECT , vol.3, no.21, pp.5934-5940, 2018 (SCI-Expanded, Scopus) identifier identifier

64. Photonic, spectroscopic properties and electronic structure of PTCDI-C8 organic nanostructure

Gunduz B., Kurban M.
VIBRATIONAL SPECTROSCOPY , vol.96, pp.46-51, 2018 (SCI-Expanded, Scopus) identifier identifier

65. Ab initio study of structural and electronic properties of SinC5-nH8 (n=0-5) series: Probing the 2D to 3D structural transition

Muz I., Kurban M.
INORGANICA CHIMICA ACTA , vol.477, pp.318-325, 2018 (SCI-Expanded, Scopus) identifier identifier

66. Analysis of the geometrical properties and electronic structure of arsenide doped boron clusters: Ab-initio approach

Muz I., Kurban M., Sanli K.
INORGANICA CHIMICA ACTA , vol.474, pp.66-72, 2018 (SCI-Expanded, Scopus) identifier identifier

67. The structural, electronic and spectroscopic properties of 4FPBAPE molecule: Experimental and theoretical study

Tanis E., Sas E. B., Kurban M., Kurt M.
JOURNAL OF MOLECULAR STRUCTURE , vol.1154, pp.301-318, 2018 (SCI-Expanded, Scopus) identifier identifier

68. Electronic structure, optical and structural properties of Si, Ni, B and N-doped a carbon nanotube: DFT study

Kurban M.
OPTIK , vol.172, pp.295-301, 2018 (SCI-Expanded, Scopus) identifier identifier

69. Size- and composition-dependent structure of ternary Cd-Te-Se nanoparticles

Kurban M.
TURKISH JOURNAL OF PHYSICS , vol.42, no.4, pp.443-454, 2018 (ESCI, Scopus, TRDizin) identifier identifier

70. Electronic structure, optical and structural properties of organic 5,5 '-Dibromo-2,2 '-bithiophene

Kurban M., Gunduz B.
OPTIK , vol.165, pp.370-379, 2018 (SCI-Expanded, Scopus) identifier identifier

71. Study of structural, optical properties and electronic structure of PTCDI-C5 organic nanostructure

Kurban M., Gunduz B.
CHEMICAL PHYSICS LETTERS , vol.691, pp.14-21, 2018 (SCI-Expanded, Scopus) identifier identifier

72. Physical and optical properties of DCJTB dye for OLED display applications: Experimental and theoretical investigation

Kurban M., Gunduz B.
JOURNAL OF MOLECULAR STRUCTURE , vol.1137, pp.403-411, 2017 (SCI-Expanded, Scopus) identifier identifier

73. Segregation formation, thermal and electronic properties of ternary cubic CdZnTe clusters: MD simulations and DFT calculations

Kurban M., Erkoc S.
PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES , vol.88, pp.243-251, 2017 (SCI-Expanded, Scopus) identifier identifier

74. Mechanical properties of CdZnTe nanowires under uniaxial stretching and compression: A molecular dynamics simulation study

Kurban M., Erkoc S.
COMPUTATIONAL MATERIALS SCIENCE , vol.122, pp.295-300, 2016 (SCI-Expanded, Scopus) identifier identifier

75. Investigation of the Structural Properties of CdTe and ZnTe Binary Nanorods Under Heat Treatment Molecular Dynamics Simulations

KURBAN M., ŞAKŞİR E.
Quantum Matter , vol.5, no.4, pp.602-606, 2016 (Peer-Reviewed Journal)

76. Structural and thermal properties of Cd-Zn-Te ternary nanoparticles: Molecular-dynamics simulations

Kurban M., MALCIOĞLU O. B., Erkoc S.
CHEMICAL PHYSICS , vol.464, pp.40-45, 2016 (SCI-Expanded, Scopus) identifier identifier

77. Microstructural properties and local atomic structures of cobalt oxide nanoparticles synthesised by mechanical ball-milling process

Akgul F. A., Akgul G., Kurban M.
PHILOSOPHICAL MAGAZINE , vol.96, no.30, pp.3211-3226, 2016 (SCI-Expanded, Scopus) identifier identifier

78. Structural and Electronic Properties of ZnmCdn,Te-k (m plus n plus k=2-4) Clusters: DFT Calculations

Kurban M., Erkoc S.
JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , vol.12, no.9, pp.2605-2615, 2015 (SCI-Expanded, Scopus) identifier identifier

79. Structural properties of ZnxCd1 xTe x 0 25 0 50 and 0 75 ternary nanorods Molecular Dynamics Simulations

KURBAN M., ERKOÇ Ş.
Research and Reviews: Journal of Pure and Applied Physics , vol.1, no.4, pp.35-42, 2013 (Peer-Reviewed Journal)

80. Quantum dynamics of H(S-2) + FO((2)Pi) -> HF((1)Sigma(+)) + O(P-3) reaction on the 1(3)A ' state

Kurban M., GÖKTAŞ F., Karabulut E., Tutuk R.
MOLECULAR PHYSICS , vol.109, no.5, pp.789-795, 2011 (SCI-Expanded, Scopus) identifier identifier

81. Time-Dependent Quantum Study of H(S-2)+FO((2)Pi) -> OH((2)Pi)+F(P-2) Reaction on the 1(3)A ' and 1(3)A '' States

GÖKTAŞ F., Tutuk R., Kurban M.
JOURNAL OF COMPUTATIONAL CHEMISTRY , vol.31, no.14, pp.2607-2611, 2010 (SCI-Expanded, Scopus) identifier identifier identifier
Papers Presented at Peer-Reviewed Scientific Conferences 58

1. Predicting Optical Bandgaps in C60 and Functionalized Derivatives from Limited Data for Renewable Energy Applications

Tunçel M., Kurban H., Serpedin E., KURBAN M.
19th IEEE International Conference on Compatibility, Power Electronics and Power Engineering, CPE-POWERENG 2025, Antalya, Turkey, 20 - 22 May 2025, (Full Text) identifier

2. Instance-Based Learning-Driven Density of States Analysis in Functionalized Fullerene Derivatives for Optimizing Organic Photovoltaics

Sharma P., Kurban H., Dalkilic M., KURBAN M.
19th IEEE International Conference on Compatibility, Power Electronics and Power Engineering, CPE-POWERENG 2025, Antalya, Turkey, 20 - 22 May 2025, (Full Text) identifier

3. Data-Efficient Hydrogen Adsorption Prediction in Copper Nanoclusters: A Computer Vision-Based Transfer Learning Approach

Polat C., Kurban H., Serpedin E., KURBAN M.
19th IEEE International Conference on Compatibility, Power Electronics and Power Engineering, CPE-POWERENG 2025, Antalya, Turkey, 20 - 22 May 2025, (Full Text) identifier

4. Potential of Carbon and Boron Nitride Nanotubes for Drug Delivery Established by Analysis of Curcumin-Nanotubes Binding Interactions : A DFT Investigation

BECHOHRA L. L., KURBAN M., MEDIGUE N. E. H., KELLOU-TAIRI S.
2nd National Conference on Materials Sciences and Engineering (MSE’23), Maghnia, Algeria, 12 December 2023, (Summary Text)

5. Effect of Sulfur Doping on Electronic Structure of ZnO Nanoparticles

MUZ İ., KURBAN M.
5th International Eurasian Conference on Biological and Chemical Sciences, Ankara, Turkey, 23 November 2022, (Summary Text)

6. Predicting Atom Types of Anatase TiO2 Nanoparticles with Machine Learning

KURBAN H., KURBAN M., Sharma P., Dalkılıç M.
International Conference on Engineering and Innovative Materials, Singapore, 4 - 06 September 2020, vol.880, pp.89-94, (Full Text) identifier

7. Structural and electronic properties of favipiravir drug adsorption on the C30B15N15 heterofullerene: DFT studies

MUZ İ., KURBAN M.
3rd International Conference on Physical Chemistry and Functional Materials, Malatya, Turkey, 22 - 24 September 2020, (Summary Text)

8. Functionalized graphdiyne: Size-Dependent electronic and optical properties based on DFTB

KURBAN M., MUZ İ.
3rd International Conference on Physical Chemistry and Functional Materials, Malatya, Turkey, 22 - 24 September 2020, (Summary Text)

9. Investigation of Electrical and Structural Properties of ZrO2 Thin Films

COŞKUN B., KURBAN M.
6th International Conference on Materials Science and Nanotechnology for Next Generation (MSNG2019), Niğde, Turkey, 16 - 18 December 2019, pp.349-351, (Full Text)

10. INVESTIGATION OF ELECTRONIC STRUCTURE AND THERMALPROPERTIES OF NANO-SATURN FOR FUNCTIONAL MATERIALS

KURBAN M.
ADIM PHYSICS DAYS VIII, 12 - 15 August 2019, pp.142-151, (Full Text)

11. Size Dependent Electronic Structure and Structural Properties of Cupric Oxide (CuO) Nanoparticles

KURBAN H., KURBAN M., Dalkılıç M.
International Natural Science, Engineering and Material Technologies Conference, İstanbul, Turkey, 9 - 10 September 2019, (Full Text)

12. Controlling Structural and Electronic Properties of ZnO NPs: Density-Functional Tight-Binding Method

KURBAN M., KURBAN H., Dalkılıç M.
2nd International Conferences on Science and Technology Natural Science and Technology, Prizren, Serbia, 26 - 30 August 2019, pp.23-30, (Full Text)

13. The Effects of a Single Atom Substitution and Temperature on Electronic and Photophysical Properties F8T2 Organic Material

KURBAN M.
2nd International Conferences on Science and Technology Natural Science and Technology, 26 - 30 August 2019, pp.31-38, (Full Text)

14. Assessment of Long-Range Corrected (LC) Parameters for Prediction of Electronic Structure of Carbazole

KURBAN M.
International Natural Science, Engineering and Material Technologies Conference, İstanbul, Turkey, 9 - 10 September 2019, (Full Text)

15. Band Engineering and Photophysical Properties of C-Doped F8T2 Organic Compound

KURBAN M., COŞKUN B.
International Natural Science, Engineering and Material Technologies Conference, 9 - 10 September 2019, (Full Text)

16. A DFT comparative study of electronic properties on pristine single walled carbon nanotubes

MUZ İ., KURBAN M.
International Conference on Materials Science, Mechanical and Automotive Engineerings and Technology, Nevşehir, Turkey, 21 - 23 June 2019, (Summary Text)

17. Electronic properties of (4,4) carbon nanotube via 3A, 4A and 5A group atoms doping

MUZ İ., KURBAN M.
2nd International Conference on Physical Chemistry and Functional Materials, Nevşehir, Turkey, 25 - 27 June 2019, (Summary Text)

18. Predicting Chemical Bioavailability of Fluoxastrobin by DFT calculations

TANIŞ E., KURBAN M., ÖZKAN KOTİLOĞLU S., ÇELİK S.
International Congress on the World of Technology and Advanced Materials (WITAM-2018), Kırşehir, Turkey, 21 - 23 September 2018, pp.16, (Full Text)

19. Evaluation of Performance of Functionals to Estimate Charge Transport Properties and Excited-State Energies

BABUR ŞAŞ E., KURBAN M., GÜNDÜZ B., KURT M.
International Congress on the World of Technology and Advanced Materials (WITAM-2018), Kırşehir, Turkey, 21 - 23 September 2018, (Full Text)

20. Structural, thermal and vibrational properties of poly-hexamethylene biguanide hydrochloride (PHMB)

ÇELİK S., KURBAN M., ÖZKAN KOTİLOĞLU S., TANIŞ E.
International Congress on the World of Technology and Advanced Materials (WITAM-2018), Kırşehir, Turkey, 21 - 23 September 2018, (Summary Text)

21. Investigation of photophysical and toxicity properties of Pyraclostrobin

ÇELİK S., TANIŞ E., ÖZKAN KOTİLOĞLU S., KURBAN M.
International Congress on the World of Technology and Advanced Materials (WITAM-2018), Kırşehir, Turkey, 21 - 23 September 2018, pp.33, (Summary Text)

22. Electronic Structure, Optical and Spectroscopic Properties of BCzVB Organic Molecule

GÜNDÜZ B., KURBAN M.
International Conference on Physical Chemistry and Functional Materials (PCFM’xx18), Elazığ, Turkey, 19 - 21 June 2018, pp.315, (Summary Text)

23. Controlling Photophysical Properties and Electronic Structure of PTCDI-C8 Nanostructure

GÜNDÜZ B., KURBAN M.
International Conference on Physical Chemistry and Functional Materials (PCFM’xx18), Elazığ, Turkey, 19 - 21 June 2018, pp.3-5, (Full Text)

24. Unusual structural phase transition properties of GaAs Clusters under pressure

KURBAN M., KÜRKÇÜ C.
4TH INTERNATIONAL CONFERENCE ON ENGINEERING AND NATURAL SCIENCES, Kiev, Ukraine, 2 - 06 May 2018, pp.509, (Summary Text)

25. Effects of Doped Atoms on the Structural, Electronic and Optical Properties of a Carbon Nanotube

KURBAN M., GÖKTAŞ F.
4TH INTERNATIONAL CONFERENCE ON ENGINEERING AND NATURAL SCIENCES, Kiev, Ukraine, 2 - 06 May 2018, (Summary Text)

26. 2D-3D STRUCTURAL TRANSITION IN SinC5-nH8 (n=0-5) SERIES

MUZ İ., KURBAN M.
International Conference on Material Science and Technology in Cappadocia (IMSTEC’17), 11 - 13 October 2017, (Summary Text)

27. Investigation of Some Physical Features of GaAs Nanoparticles for Solar Cell Applications

KURBAN M., GÖKTAŞ F.
INTERNATIONAL CONFERENCE ON CONDENSED MATTER AND MATERIALS SCIENCE, 11 - 15 October 2017, (Summary Text)

28. UNDERSTANDING THE STRUCTURAL PROPERTIES OF CdTeSe NANOPARTICLES FOR SOLAR CELL APPLICATIONS

KURBAN M., MUZ İ.
International Conference on Material Science and Technology in Cappadocia (IMSTEC’17), 11 - 13 October 2017, (Summary Text)

29. ELECTRONIC PROPERTIES OF CO3O4 NANOCLUSTER FROM DENSITY-FUNCTIONAL CALCULATIONS

MUZ İ., KURBAN M.
International Conference on Material Science and Technology in Cappadocia (IMSTEC’17), 11 - 13 October 2017, (Summary Text)

30. THE STRUCTURE AND ENERGETIC OF ARSENIDE DOPED BORON CLUSTERS (N=1-9)

MUZ İ., KURBAN M., Şanlı K.
International Conference on Material Science and Technology in Cappadocia (IMSTEC’17), 11 - 13 October 2017, (Full Text)

31. Molecular Dynamics Simulation of Cu55 Magic Cluster on the Graphene Monolayer

KURBAN M., Erkoç Ş.
INTERNATIONAL CONFERENCE ON CONDENSED MATTER AND MATERIALS SCIENCE, 11 - 15 October 2017, (Summary Text)

32. Investigation of geometrical, electronic and spectroscopic properties of Fluorene-9-phenol molecule

ÇELİK S., KURBAN M., ÖZKAN KOTİLOĞLU S., TANIŞ E.
III. International Turkish Congress on Molecular Spectroscopy, Bodrum, Turkey, 26 - 29 August 2017, pp.108, (Summary Text)

33. A theoretical study of solvent effects on 2-acetoxybenzoic acid molecule

ÇELİK S., TANIŞ E., ÖZKAN KOTİLOĞLU S., KURBAN M.
III. International Turkish Congress on Molecular Spectroscopy, Bodrum, Turkey, 26 - 29 August 2017, pp.154, (Summary Text)

34. UV Characterizations of 5-Bromo-2-nitropyridine: Experimental and Theoretical Research

KURBAN M., GÜNDÜZ B.
4th Internatıonal conference on materials science and nanotechnology for next generation (MSNG2017), Sarajevo, Bosnia And Herzegovina, 28 - 30 June 2017, pp.52, (Summary Text)

35. Experimental and Theoretical Study on the Electronic and Optoelectronic Properties of 5,5′-Dibromo-2,2′-bithiophene Organic Material for Photovoltaic Application

KURBAN M., GÜNDÜZ B.
4th International conference on materials and nanotachnology for next generation (MSNG2017)), Sarajevo, Bosnia And Herzegovina, 28 - 30 June 2017, pp.51, (Summary Text)

36. Determination of electronic spectroscopic and optical properties of DCJTB semiconductor by experimental solution technique and theoretical quantum mechanical method

GÜNDÜZ B., KURBAN M.
2nd International Advanced and Functional Materials Technologies (AFMAT), Antalya, Turkey, 20 - 22 October 2016, pp.36, (Summary Text)

37. Computational and experimental thin film investigations on structure energetics and spectroscopy properties of DCJTB

KURBAN M., GÜNDÜZ B.
2nd International Anvanced and Functional Materials Technologies (AFMAT), Antalya, Turkey, 20 - 22 October 2016, pp.31, (Summary Text)

38. Size dependence and segregation phenomena of copper hydrid nanoparticles A molecular dynamics study

KURBAN M.
Turkish Physical Society 32nd International Physics Conference, Bodrum, Turkey, 6 - 09 September 2016, (Summary Text)

39. A molecular dynamics study on the geometrical and energetics properties of Gallium Arsenide nanoparticles under heat treatment

KURBAN M.
Turkish Physical Society 32nd International Physics Conference, Bodrum, Turkey, 6 - 09 September 2016, (Summary Text)

40. Core and surface segregation and thermal properties of CdTe0 50Se0 50 ternary nanoparticles

KURBAN M.
12th International Nanoscience and Nanotechnology Conference, Gebze, Turkey, 3 - 05 June 2016, pp.98, (Summary Text)

41. Geometrical and energetic properties of 15 atom ternary Cd Zn Te clusters

KURBAN M., ERKOÇ Ş.
9th International Physics Conference of the Balkan Physical Union, İstanbul, Turkey, 24 - 27 August 2015, pp.373, (Summary Text)

42. CdxZnyTez Nanoparçacıkların Termodinamik Özelliklerinin Moleküler Dinamiği Benzetimiile İncelenmes

KURBAN M., MALCIOĞLU O. B., ERKOÇ Ş.
20. YOĞUN MADDE FİZİĞİ ANKARA TOPLANTISI, Ankara, Turkey, 26 December 2014, pp.16, (Summary Text)

43. Size dependence and heat capacity of CdZnTe and CdZn nanoparticles Molecular dynamics simulations

KURBAN M., MALCIOĞLU O. B., ERKOÇ Ş.
31th international physics congress, Bodrum, Turkey, 21 - 24 July 2014, pp.295, (Summary Text)

44. Proper Gaussian basis sets for density functional studies of cobalt oxide clusters

KURBAN M., ERKOÇ Ş.
31th international physics congress, Bodrum, Turkey, 21 - 24 July 2014, pp.297, (Summary Text)

45. A molecular dynamics study of the heat capacity of CdTe and ZnTe nanoparticles

KURBAN M., MALCIOĞLU O. B., ERKOÇ Ş.
31th international physics congress, Bodrum, Turkey, 21 - 24 July 2014, pp.296, (Summary Text)

46. Structural properties of ZnTe and CdTe binary nanorods Molecular Dynamics Simulations

KURBAN M., ERKOÇ Ş.
30th Internatıonal Physics Congress, İstanbul, Turkey, 2 - 05 September 2013, pp.371, (Summary Text)

47. Structural and electronic properties of ZnmCdnTek m n k 2 4 clusters Density functional theory calculations

KURBAN M., ERKOÇ Ş.
9TH NANOSCIENCE AND NANOTECHNOLOGY CONFERENCE, Erzurum, Turkey, 24 - 28 June 2013, pp.124, (Summary Text)

48. Structural properties of ZnxCd1 xTe x 0 25 and 0 50 nanorods

KURBAN M., ERKOÇ Ş.
8th NANOSCIENCE AND NANOTECHNOLOGHY CONGRESS, Ankara, Turkey, 25 - 29 June 2012, pp.234, (Summary Text)

49. Time Dependent Quantum Study of the H 2S FO 2 OH 2 F 2P Reaction

TUTUK R., KARABULUT E., KURBAN M., GÖKTAŞ F.
26. ULUSLARARASI FİZİK KONGRESİ, Bodrum, Turkey, 24 - 27 September 2009, pp.339, (Summary Text)

50. Quantum Wave Packet Study of D FO Reaction

KURBAN M., KARABULUT E., TUTUK R., GÖKTAŞ F.
26. ULUSLARARASI FİZİK KONGRESİ, Bodrum, Turkey, 24 - 27 September 2009, pp.316, (Summary Text)

51. Quantum Real Wave packet Study of H 2S FO 2 HF 1 O 3P Reaction on the 13A State

KURBAN M., KARABULUT E., TUTUK R., GÖKTAŞ F.
27TH INTERNATINONAL PHYSICS CONGRESS, İstanbul, Turkey, 14 - 17 September 2010, pp.468, (Summary Text)

52. Quantum Dynamics Study of H LiF reaction

KARABULUT E., KURBAN M., TUTUK R., GÖKTAŞ F.
27 TH INTERNATIONAL PHYSCIS CONGRESS, İstanbul, Turkey, 14 - 17 September 2010, pp.457, (Summary Text)

53. Isotope Effects in the XLiF -- XF Li (X = H , D) Reaction

KARABULUT E., KURBAN M., TUTUK R., GÖKTAŞ F.
27 TH INTERNATIONAL PHYSCIS CONGRESS, İstanbul, Turkey, 14 - 17 September 2010, pp.458, (Summary Text)

54. Time Dependent Quantum Study of the Reaction of Hydrogen Isotopes and Flouroxide Molecule

KURBAN M., KARABULUT E., GÖKTAŞ F.
27 TH INTERNATIONAL PHYSICS CONGRESS, İstanbul, Turkey, 14 - 17 September 2010, pp.470, (Summary Text)

55. Quantum Wave Packet Study of the HCaCI( v, j) -- HCI ( v, j) Ca Reaction

TUTUK R., KARABULUT E., KURBAN M., GÖKTAŞ F.
27TH INTERNATİONAL PHYSİCS CONGRESS, İstanbul, Turkey, 14 - 17 September 2010, pp.88, (Summary Text)

56. Quantum Wave Packet Calculation of Reaction Probabilities Cross Section and Rate Constant for H FO System on the 11A State

KURBAN M., GÖKTAŞ F.
27 TH INTERNATIONAL PHYSICS CONGRESS, İstanbul, Turkey, 14 - 17 September 2010, pp.471, (Summary Text)

57. Time Dependent Quantum Dynamics study of Reactive Scattering of the H OF Reaction on the 13A and 13A States

KURBAN M., GÖKTAŞ F., KARABULUT E., TUTUK R.
27 TH INTERNATIONAL PHYSICS CONGRESS, İstanbul, Turkey, 14 - 17 September 2010, pp.469, (Summary Text)

58. The Investigation of Photo Dissociation by Time Dependent Quantum Method

KURBAN M., KARABULUT E., TUTUK R., GÖKTAŞ F.
26. ULUSLARARASI FİZİK KONGRESİ, Bodrum, Turkey, 24 - 27 September 2009, pp.317, (Summary Text)
Books 2

1. Ternary II-VI Alloys Promising for Application in Photodetectors

KURBAN M., MALCIOĞLU O. B., Erkoç Ş.
in: Handbook of II-VI Semiconductor-Based Sensors and Radiation Detectors, Ghenadii Korotcenkov, Editor, Springer, Cham, Cham, pp.87-106, 2023

2. II-VI Semiconductors Bandgap Engineering

KURBAN M., ŞİMŞEK Y., Erkoç Ş.
in: Handbook of II-VI Semiconductor-Based Sensors and Radiation Detectors, Ghenadii Korotcenkov, Editor, Springer, Cham, cham, pp.109-131, 2023
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