Prof. Dr. ŞAKİR ERKO&#199;

INTERNATIONAL JOURNAL OF MODERN PHYSICS B , cilt.32, sa.3, 2018 (SCI-Expanded, Scopus)

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

KURBAN M., ERKOÇ Ş.

PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES , cilt.88, ss.243-251, 2017 (SCI-Expanded, Scopus)

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

Kurban M., ERKOÇ Ş.

COMPUTATIONAL MATERIALS SCIENCE , cilt.122, ss.295-300, 2016 (SCI-Expanded, Scopus)

7. Structural Properties of Pristine and Defected ZnO Nanosheets Under Biaxial Strain: Molecular Dynamics Simulations

Kurban M., Malcioglu O. B., ERKOÇ Ş.

JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY , cilt.16, sa.2, ss.1506-1516, 2016 (SCI-Expanded, Scopus)

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

CHEMICAL PHYSICS , cilt.464, ss.40-45, 2016 (SCI-Expanded, Scopus)

9. Structural properties of indium phosphide nanorods: molecular dynamics simulations

Nayir N., TAŞCI E., ERKOÇ Ş.

INTERNATIONAL JOURNAL OF NANOTECHNOLOGY , cilt.13, ss.809-831, 2016 (SCI-Expanded, Scopus)

10. The influence of instructional interactions on students' mental models about the quantization of physical observables: a modern physics course case

Korhasan N. D., ERYILMAZ A., ERKOC Ş.

EUROPEAN JOURNAL OF PHYSICS , cilt.37, sa.1, 2016 (SCI-Expanded, Scopus)

11. Structural and Thermal Properties of Indium Phosphide Nanoparticles: Molecular Dynamics Simulations

Nayir N., Tasci E. S., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.12, sa.9, ss.2134-2139, 2015 (SCI-Expanded, Scopus)

12. Structural Properties of Monolayer Boron Carbide Nanoribbons Under Strain: Molecular Dynamics Simulations

Simsek Y., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.12, sa.9, ss.2180-2188, 2015 (SCI-Expanded, Scopus)

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

Kurban M., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.12, sa.9, ss.2605-2615, 2015 (SCI-Expanded, Scopus)

14. Carbon Nanobuggy is Ready for a Test Drive!

Tasci E. S., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.12, sa.6, ss.1083-1085, 2015 (SCI-Expanded, Scopus)

15. X-Doped (X = C, N, F, P) ZnO Sheet: Density Functional Theory Calculations

KÖKTEN H., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.12, sa.3, ss.395-398, 2015 (SCI-Expanded, Scopus)

16. Study of the Influence of Transition Metal Atoms on Electronic and Magnetic Properties of Graphyne Nanotubes Using Density Functional Theory

Alaei S., Jalili S., ERKOÇ Ş.

FULLERENES NANOTUBES AND CARBON NANOSTRUCTURES , cilt.23, sa.6, ss.494-499, 2015 (SCI-Expanded, Scopus)

17. Two common terminological mistakes in scientific papers

ERKOÇ Ş.

TURKISH JOURNAL OF PHYSICS , cilt.39, sa.3, ss.314-315, 2015 (ESCI, Scopus, TRDizin)

18. Investigating students' mental models about the quantization of light, energy, and angular momentum

Didis N., ERYILMAZ A., ERKOC Ş.

PHYSICAL REVIEW SPECIAL TOPICS-PHYSICS EDUCATION RESEARCH , cilt.10, sa.2, 2014 (SCI-Expanded, SSCI, Scopus)

19. Structural properties of defected ZnO nanoribbons under uniaxial strain: Molecular dynamics simulations

CURRENT APPLIED PHYSICS , cilt.14, sa.1, ss.57-67, 2014 (SCI-Expanded, Scopus)

20. Structural Properties of beta-Fe2O3 Nanorods Under Strain: Molecular Dynamics Simulations

Alaei S., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.11, sa.1, ss.242-248, 2014 (SCI-Expanded, Scopus)

21. Evolution of the electronic structure and properties of charged titanium doped aluminum nanoclusters

ERDOĞDU Y., ERKOÇ Ş.

COMPUTATIONAL MATERIALS SCIENCE , cilt.79, ss.599-610, 2013 (SCI-Expanded, Scopus)

22. Structural Properties of ZnO Nanotubes Under Uniaxial Strain: Molecular Dynamics Simulations

JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY , cilt.13, sa.10, ss.6597-6610, 2013 (SCI-Expanded, Scopus)

23. Structural Properties of ZnO Nanoparticels and Nanorings: Molecular Dynamics Simulations

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.10, sa.6, ss.1490-1496, 2013 (SCI-Expanded, Scopus)

24. Molecular Dynamic Simulations of Pristine and Defective Graphene Nanoribbons Under Strain

Tuzun B., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.10, sa.2, ss.470-480, 2013 (SCI-Expanded, Scopus)

25. Structural Properties of Silicon Nanorods Under Strain: Molecular Dynamics Simulations

Ozdamar B., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.10, sa.1, ss.1-9, 2013 (SCI-Expanded, Scopus)

26. Molecular Dynamics Simulations of ZnO Nanostructures Under Strain: II-Nanorods

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.10, sa.1, ss.112-118, 2013 (SCI-Expanded, Scopus)

27. Molecular Dynamics Simulations of Zinc Oxide Nanostructures Under Strain: I-Nanoribbons

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.10, sa.1, ss.104-111, 2013 (SCI-Expanded, Scopus)

28. GROUP 12 ELEMENTS AND THEIR SMALL CLUSTERS: ELECTRIC DIPOLE POLARIZABILITY OF Zn, Cd AND H-g, Zn-2 DIMER AND HIGHER Zn-n MICROCLUSTERS AND NEUTRAL, CATIONIC AND ANIONIC ZINC OXIDE MOLECULES (ZnO, ZnO+ AND ZnO-)

Oymak H., ERKOÇ Ş.

INTERNATIONAL JOURNAL OF MODERN PHYSICS B , cilt.26, sa.8, 2012 (SCI-Expanded, Scopus)

29. Molecular-dynamics simulations of silicene nanoribbons under strain

Ince A., ERKOÇ Ş.

PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS , cilt.249, sa.1, ss.74-81, 2012 (SCI-Expanded, Scopus)

30. Energetics and structural properties of carbon and oxygen doped hexagonal boron nitride sheets

KÖKTEN H., ERKOÇ Ş.

PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES , cilt.44, sa.1, ss.215-217, 2011 (SCI-Expanded, Scopus)

31. Structural properties of boron carbide nanoparticles: Application of a new set of Stillinger-Weber parameters

COMPUTATIONAL MATERIALS SCIENCE , cilt.50, sa.10, ss.2950-2954, 2011 (SCI-Expanded, Scopus)

32. Investigation of Metal and Non-Metal Doped Dimer and Trimer C-60 Fullerene Chains as Prospective Spin Cluster Qubits

Polad S., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.8, sa.4, ss.694-706, 2011 (SCI-Expanded, Scopus)

33. Silicene nanoribbons: Molecular-dynamics simulations

Ince A., ERKOÇ Ş.

COMPUTATIONAL MATERIALS SCIENCE , cilt.50, sa.3, ss.865-870, 2011 (SCI-Expanded, Scopus)

34. Effects of Water Related Defects on Pentacene and Picene Molecules

DİDİŞ KÖRHASAN N., ERYILMAZ A., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.7, sa.10, ss.1889-1893, 2010 (SCI-Expanded, Scopus)

35. Quantum chemical treatment of beta-sitosterol molecule

Kurban S., ERKOÇ F., ERKOÇ Ş.

PHARMACEUTICAL BIOLOGY , cilt.48, sa.6, ss.637-642, 2010 (SCI-Expanded, Scopus)

36. Pre service Physics Teachers Comprehension of Quantum Mechanical Concepts

Eurasia Journal of Mathematics, Science & Technology Education , cilt.6, ss.227-235, 2010 (Hakemli Dergi)

37. Density Functional Theory Calculations on Polyacene Molecules

ERKOÇ Ş., ERKOÇ F., SEPİCİ DİNÇEL A.

ADVANCED SCIENCE LETTERS , cilt.3, sa.1, ss.43-48, 2010 (SCI-Expanded, Scopus)

38. On the SmCo Dimer: A Detailed Density Functional Theory Analysis

Oymak H., ERKOÇ Ş.

JOURNAL OF PHYSICAL CHEMISTRY A , cilt.114, sa.4, ss.1897-1905, 2010 (SCI-Expanded, Scopus)

39. Quantum chemical investigation of nitrotyrosine (3-nitro-L-tyrosine) and 8-nitroguanine

AMINO ACIDS , cilt.38, sa.1, ss.319-327, 2010 (SCI-Expanded, Scopus)

40. Structural and electronic features of the ubiquinone and ubiquinol molecules: molecular dynamics and quantum chemical treatments

Tekin E. D., ERKOÇ Ş.

MOLECULAR SIMULATION , cilt.36, sa.10, ss.763-771, 2010 (SCI-Expanded, Scopus)

41. Structural and electronic properties of carbon-doped c-BN(110) surface

KÖKTEN H., ERKOÇ Ş.

PHYSICA B-CONDENSED MATTER , cilt.404, ss.4937-4938, 2009 (SCI-Expanded, Scopus)

42. A theoretical study of chemical doping and width effect on zigzag graphene nanoribbons

PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES , cilt.42, sa.2, ss.110-115, 2009 (SCI-Expanded, Scopus)

43. Quantum-chemical treatment of the linoleic acid molecule and two of its conjugated isomers

Kurban S., ERKOÇ F., ERKOÇ Ş.

EUROPEAN JOURNAL OF LIPID SCIENCE AND TECHNOLOGY , cilt.111, sa.10, ss.1035-1041, 2009 (SCI-Expanded, Scopus)

44. Analyzing Fe-Zn system using molecular dynamics, evolutionary neural nets and multi-objective genetic algorithms

Bhattacharya B., Kumar G. R. D., Agarwal A., ERKOÇ Ş., Singh A., Chakraborti N.

COMPUTATIONAL MATERIALS SCIENCE , cilt.46, sa.4, ss.821-827, 2009 (SCI-Expanded, Scopus)

45. Structural and thermochemical properties, and energetics of C-8(NO2)(8) and C-20(NO2)(4n) (n=0-4)

COMPUTATIONAL MATERIALS SCIENCE , cilt.46, sa.4, ss.849-853, 2009 (SCI-Expanded, Scopus)

46. A density functional theory study on the structures and energetics of CdmTen clusters (m + n <= 6)

MALCIOĞLU O. B., ERKOÇ Ş.

COMPUTATIONAL MATERIALS SCIENCE , cilt.45, sa.4, ss.912-920, 2009 (SCI-Expanded, Scopus)

47. On the Possibility of a Polymer-Like Nanorod Based on Columnar Stacked Single Benzenoid Carbon Rings

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.6, sa.4, ss.903-907, 2009 (SCI-Expanded, Scopus)

48. Molecular Mechanics and Molecular Dynamics Simulations of Carbon Based Nanogears

Tasci E., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.6, sa.4, ss.921-925, 2009 (SCI-Expanded, Scopus)

49. Structural and Electronic Properties of GamSen Microclusters: Density Functional Theory Calculations

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.6, sa.4, ss.908-920, 2009 (SCI-Expanded, Scopus)

50. Structural, Electronic and Magnetic Properties of BN Nanotubes Doped with Mn and Cr: Exploring the Potential for Device Technology

KÖKTEN H., Ustunel H., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.6, sa.4, ss.926-932, 2009 (SCI-Expanded, Scopus)

51. Enhancement of H-2 Storage in Carbon Nanotubes via Doping with a Boron Nitride Ring

Onay A. K., ERKOÇ Ş.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.6, sa.4, ss.933-941, 2009 (SCI-Expanded, Scopus)

52. A Special Issue on Physics and Chemistry of Nanoparticles

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.6, sa.4, ss.805, 2009 (SCI-Expanded, Scopus)

53. Genetic algorithm-Monte Carlo hybrid geometry optimization method for atomic clusters

COMPUTATIONAL MATERIALS SCIENCE , cilt.45, sa.1, ss.127-132, 2009 (SCI-Expanded, Scopus)

54. Endohedral Li/Li+ Doped Stone-Wales Defected Carbon Nanocapsules

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.6, sa.1, ss.30-40, 2009 (SCI-Expanded, Scopus)

55. Genetic Algorithm Application to the Structural Properties of Si-Ge Mixed Clusters

MATERIALS AND MANUFACTURING PROCESSES , cilt.24, sa.3, ss.250-254, 2009 (SCI-Expanded, Scopus)

56. Density functional theory study on the structural properties and energetics of Zn(m)Te(n) microclusters

PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES , cilt.40, sa.9, ss.2921-2930, 2008 (SCI-Expanded, Scopus)

57. Quantum chemical calculations of warfarin sodium, warfarin and its metabolites

Tekin E. D. (., ERKOÇ F., YILDIZ İ., ERKOÇ Ş.

COMMUNICATIONS IN COMPUTATIONAL PHYSICS , cilt.4, sa.1, ss.161-176, 2008 (SCI-Expanded, Scopus)

58. Quantum chemical treatment of Li/Li+ doped defected carbon nanocapsules

PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES , cilt.40, sa.8, ss.2752-2760, 2008 (SCI-Expanded, Scopus)

59. Stability analysis of graphene nanoribbons by molecular dynamics simulations

PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS , cilt.245, sa.4, ss.695-700, 2008 (SCI-Expanded, Scopus)

60. Li+ and Li interactions with carbon nanocage structures

MALCIOĞLU O. B., ERKOÇ Ş.

JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY , cilt.8, sa.2, ss.675-678, 2008 (SCI-Expanded, Scopus)

61. Functionality of C(4,4) carbon nanotube as molecular detector

JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY , cilt.8, sa.2, ss.469-478, 2008 (SCI-Expanded, Scopus)

62. Structural properties and stability of nanoclusters

Ustuenel H., Erkoc S.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.4, sa.5, ss.928-956, 2007 (SCI-Expanded, Scopus)

63. Structural and electronic properties of defected carbon nanocapsules

Pekoez R., Erkoc S.

JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE , cilt.4, sa.4, ss.764-771, 2007 (SCI-Expanded, Scopus)

64. Evolutionary and genetic algorithms applied to Li+-C system: Calculations using differential evolution and particle swarm algorithm

Chakraborti N., Jayakanth R., Das S., Calisir E. A., Erkoc S.

JOURNAL OF PHASE EQUILIBRIA AND DIFFUSION , cilt.28, sa.2, ss.140-149, 2007 (SCI-Expanded, Scopus) Sürdürülebilir Kalkınma

65. An algorithm for constructing various kinds of nanojunctions using zig-zag and armchair nanotubes

Tasci E., Erkoc S.

JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY , cilt.7, ss.1653-1661, 2007 (SCI-Expanded, Scopus)

66. Structural and electronic properties of lithium endohedral doped carbon nanocapsules

Pekoz R., Erkoc S.

PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES , cilt.36, sa.2, ss.211-216, 2007 (SCI-Expanded, Scopus)

67. Chapter 8 Thermal stability of carbon nanosystems: Molecular-dynamics simulations

Erkoç Ş., MALCIOĞLU O. B., TAŞCI E.

Theoretical and Computational Chemistry , cilt.18, ss.201-226, 2007 (Scopus)

68. Genetic algorithms applied to Li+ ions contained in carbon nanotubes: An investigation using particle swarm optimization and differential evolution along with molecular dynamics

Chakraborti N., Das S., Jayakanth R., Pekoz R., Erkoc S.

MATERIALS AND MANUFACTURING PROCESSES , cilt.22, ss.562-569, 2007 (SCI-Expanded, Scopus) Sürdürülebilir Kalkınma

69. Thermal Stability of Carbon Nanosystems: Molecular-Dynamics Simulations

Erkoc S., MALCIOĞLU O. B., TAŞCI E.

NANOMATERIALS: DESIGN AND SIMULATION , cilt.18, ss.201-226, 2007 (SCI-Expanded, Scopus)

70. Structural, electronic and QSAR properties of the cyfluthrin molecule: A theoretical AM1 and PM3 treatment

Calisir E. D., Erkoc S.

INTERNATIONAL JOURNAL OF MODERN PHYSICS C , cilt.17, sa.10, ss.1391-1402, 2006 (SCI-Expanded, Scopus) Sürdürülebilir Kalkınma

71. Density functional theory calculations for [C2H4N2O6]((n)) (n=0,+1,-1)

JOURNAL OF HAZARDOUS MATERIALS , cilt.136, sa.2, ss.164-169, 2006 (SCI-Expanded, Scopus)

72. Structural properties of copper nanoparticles: Modified diffusion Monte Carlo simulations

Dugan N., Erkoc S.

INTERNATIONAL JOURNAL OF MODERN PHYSICS C , cilt.17, sa.8, ss.1171-1177, 2006 (SCI-Expanded, Scopus)

73. Structural and electronic properties of dipropyl sulfide: A theoretical investigation

Calisir E. D., Erkoc S.

INTERNATIONAL JOURNAL OF MODERN PHYSICS C , cilt.17, sa.8, ss.1179-1190, 2006 (SCI-Expanded, Scopus)

74. Comment on 'Modelling complexes of H-2 molecules in fullerenes' by H. Dodziuk [Chem. Phys. Lett. 410 (2005) 39]

CHEMICAL PHYSICS LETTERS , cilt.426, ss.222-223, 2006 (SCI-Expanded, Scopus)

75. Polarizabilities and second hyperpolarizabilities of ZnmCdn clusters

Papadopoulos M. G., Reis H., Avramopoulos A., Erkoc S., Amirouche L.

MOLECULAR PHYSICS , cilt.104, ss.2027-2036, 2006 (SCI-Expanded, Scopus)

76. Structural and electronic properties of the DPPC molecule

Erkoc S., Korkmaz F.

INTERNATIONAL JOURNAL OF MODERN PHYSICS C , cilt.17, sa.7, ss.967-974, 2006 (SCI-Expanded, Scopus)

77. Structural and electronic properties of c-BN(110) surface and surface point defects

Kokten H., Erkoc S.

INTERNATIONAL JOURNAL OF MODERN PHYSICS C , cilt.17, sa.6, ss.795-803, 2006 (SCI-Expanded, Scopus)

78. Structural and electronic properties of bamboo-like carbon nanostructure

PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES , cilt.31, sa.1, ss.62-66, 2006 (SCI-Expanded, Scopus)

79. Metal atom endohedrally doped C-20 cage structure: (X@C-20; X = Ni, Fe, Co)

INTERNATIONAL JOURNAL OF MODERN PHYSICS C , cilt.16, sa.10, ss.1553-1560, 2005 (SCI-Expanded, Scopus)

80. Structural and electronic properties of single-wall ZnO nanotubes

Erkoc S., Kokten H.

PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES , cilt.28, sa.2, ss.162-170, 2005 (SCI-Expanded, Scopus)

81. Quantum chemical investigation of thalidomide molecule

Erkoc S., Erkoc F.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.719, ss.1-5, 2005 (SCI-Expanded, Scopus)

82. Correlations between the energetics of ZnCd nanoparticles and some of their corresponding bulk properties: molecular-dynamics simulations

Amirouche L., ERKOÇ Ş.

JOURNAL OF CRYSTAL GROWTH , cilt.275, 2005 (SCI-Expanded, Scopus)

83. Theoretical investigation of sulforaphane molecule

Erkoc S., Erkoc F.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.714, ss.81-85, 2005 (SCI-Expanded, Scopus)

84. Theoretical investigations of the equol molecule: semi-empirical and density functional theory calculations

Erkoc F., Yilmazer M., Erkoc S.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.713, ss.37-42, 2005 (SCI-Expanded, Scopus)

85. Cluster, surface and bulk properties of ZnCd binary alloys: Molecular-dynamics simulations

NEW FRONTIERS OF PROCESSING AND ENGINEERING IN ADVANCED MATERIALS , cilt.502, ss.51-56, 2005 (SCI-Expanded)

86. Density functional theory calculations for mercury fulminate

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.712, ss.139-142, 2004 (SCI-Expanded, Scopus)

87. Does tubular structure of carbon form only from graphine sheet?

PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES , cilt.25, sa.1, ss.69-77, 2004 (SCI-Expanded, Scopus)

88. Structure and electronic properties of heterofullerene C30B15N15

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.684, ss.117-120, 2004 (SCI-Expanded, Scopus)

89. Semi-empirical SCF-MO calculations for the structural and electronic properties of single-wall InP nanotubes

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.676, ss.109-113, 2004 (SCI-Expanded, Scopus)

90. A comparative study of empirical potential energy functions: Applications to silicon microclusters

Erkoc S., Takahashi K.

INTERNATIONAL JOURNAL OF MODERN PHYSICS C , cilt.15, sa.3, ss.403-408, 2004 (SCI-Expanded, Scopus)

91. Molecular-dynamics simulations of surface and bulk properties of Zn, Cd, and ZnCd systems

Amirouche L., Erkoc S.

PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS , cilt.241, sa.2, ss.292-297, 2004 (SCI-Expanded, Scopus)

92. A study of the Cu clusters using gray-coded genetic algorithms and differential evolution

Chakraborti N., Mishra P., Erkoc S.

JOURNAL OF PHASE EQUILIBRIA AND DIFFUSION , cilt.25, sa.1, ss.16-21, 2004 (SCI-Expanded, Scopus)

93. Structural and energetic features of AlnTinNin (n=1-16) nanoparticles: molecular-dynamics simulations

Oymak H., Erkoc S.

MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING , cilt.12, sa.1, ss.109-120, 2004 (SCI-Expanded, Scopus)

94. Ammonia deposition in fullerene: (NH3)(n) @C-60

Erkoc S., Turker L.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.640, ss.57-61, 2003 (SCI-Expanded, Scopus)

95. AlTiNi ternary alloy clusters: Molecular dynamics simulations and density functional theory calculations

Erkoc S., Oymak H.

JOURNAL OF PHYSICAL CHEMISTRY B , cilt.107, sa.44, ss.12118-12125, 2003 (SCI-Expanded, Scopus)

96. AM1 treatment of endohedrally hydrogen doped fullerene, nH(2)@C-60

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.638, ss.37-40, 2003 (SCI-Expanded, Scopus)

97. AMI treatment of substitutionally Al and P doped cyclacenes

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.637, ss.189-193, 2003 (SCI-Expanded, Scopus)

98. Structural features and energetics of Znn-mCdm (n=7,8) microclusters and Zn-50, Cd-50, and Zn25Cd25 nanoparticles: Molecular-dynamics simulations

Amirouche L., Erkoc S.

PHYSICAL REVIEW A , cilt.68, sa.4, 2003 (SCI-Expanded, Scopus)

99. AM1 treatment of substitutionally Al and P doped cyclacenes

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.636, ss.143-147, 2003 (SCI-Expanded, Scopus)

100. Structural and electronic properties of endofullerenes X@C-60

Erkoc S., Turker L.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.634, ss.195-199, 2003 (SCI-Expanded, Scopus)

101. Structural and electronic properties of ajoene molecule

Erkoc S., Sumer S., Erkoc F.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.631, ss.271-276, 2003 (SCI-Expanded, Scopus)

102. Resveratrol and its analogues resveratrol-dihydroxyl isomers: semi-empirical SCF-MO calculations

Erkoc S., Keskin N., Erkoc F.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.631, ss.67-73, 2003 (SCI-Expanded, Scopus)

103. Theoretical investigation of hydroxytyrosol and its radicals

Erkoc F., Keskin N., Erkoc S.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.625, ss.87-94, 2003 (SCI-Expanded, Scopus)

104. Structural and electronic properties of magnesium diboride

INTERNATIONAL JOURNAL OF MODERN PHYSICS C , cilt.14, sa.4, ss.483-489, 2003 (SCI-Expanded, Scopus)

105. A theoretical study on certain iron-sulfur and iron-selenium clusters

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.623, ss.17-21, 2003 (SCI-Expanded, Scopus)

106. Structural and electronic properties of neodymium diiodide

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM , cilt.623, ss.79-81, 2003 (SCI-Expanded, Scopus)

107. Structural and electronic properties of ZnmCdn microclusters: density functional theory calculations

Erkoc S., Leblebicioglu K., Halici U.

CHEMICAL PHYSICS LETTERS , cilt.369, ss.605-609, 2003 (SCI-Expanded, Scopus)

108. Application of genetic algorithms to geometry optimization of microclusters: A comparative study of empirical potential energy functions for silicon

MATERIALS AND MANUFACTURING PROCESSES , cilt.18, sa.3, ss.329-339, 2003 (SCI-Expanded, Scopus)

182. MOLECULAR-DYNAMICS COMPUTER-SIMULATION OF ALUMINUM CLUSTERS (ALN N = 3 TO 55) - EMPIRICAL MANY-BODY POTENTIAL-ENERGY FUNCTION CALCULATION

ELBAYYARI Z., ERKOC S.

PHYSICA STATUS SOLIDI B-BASIC RESEARCH , cilt.170, sa.1, ss.103-111, 1992 (SCI-Expanded, Scopus)

183. STRUCTURAL STABILITY AND ENERGETICS OF SI4 ISOMERS - TOTAL ELECTRONIC-ENERGY CALCULATION

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CHEMICAL PHYSICS LETTERS , cilt.184, ss.118-120, 1991 (SCI-Expanded, Scopus)

184. STRUCTURAL STABILITY AND ENERGETICS OF AS, SB AND BI MICROCLUSTERS - EMPIRICAL MANY-BODY POTENTIAL-ENERGY FUNCTION CALCULATION

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CHEMICAL PHYSICS LETTERS , cilt.182, sa.5, ss.451-454, 1991 (SCI-Expanded, Scopus)

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187. EMPIRICAL MANY-BODY POTENTIAL-ENERGY FUNCTION FOR SILVER AND GOLD - APPLICATION TO MICROCLUSTERS

CHEMICAL PHYSICS LETTERS , cilt.173, sa.1, ss.57-62, 1990 (SCI-Expanded, Scopus)

188. STRUCTURAL STABILITY AND ENERGETICS OF FCC METAL MICROCLUSTERS - EMPIRICAL MANY-BODY POTENTIAL-ENERGY FUNCTION CALCULATION

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189. A NEW EMPIRICAL MANY-BODY POTENTIAL-ENERGY FUNCTION - APPLICATION TO MICROCLUSTERS - ELEMENTS IN BCC, FCC, AND HCP STRUCTURES