Prof. Dr. MURAT DURANDURDU

Journal of Non-Crystalline Solids , cilt.639, 2024 (SCI-Expanded)

2. Amorphous Silicon Nanoparticles and Silicon Nanoglasses from Ab Initio Simulations

BOLAT S., Durandurdu M.

Silicon , cilt.16, sa.10, ss.4263-4271, 2024 (SCI-Expanded)

3. Amorphous GaN: Polyamorphism and crystallization at high pressure

Computational Materials Science , cilt.241, 2024 (SCI-Expanded)

4. Amorphous carbon nitride (C3N4)

Karacaoğlan A. Ö. Ç., Durandurdu M.

Journal of Non-Crystalline Solids , cilt.631, 2024 (SCI-Expanded)

5. Structural and electronic transformations of GeSe2 glass under high pressures studied by X-ray absorption spectroscopy

Mijit E., Durandurdu M., Rodrigues J. E. F., Trapananti A., Javad Rezvani S., Rosa A. D., et al.

Proceedings of the National Academy of Sciences of the United States of America , cilt.121, sa.14, 2024 (SCI-Expanded)

6. Amorphous to amorphous phase transformation in boron-rich amorphous silicon borides: an ab initio study

High Pressure Research , cilt.44, sa.4, ss.443-456, 2024 (SCI-Expanded)

7. Ab initio study of boron-rich amorphous boron carbides

Yıldız T. A., DURANDURDU M.

Journal of the American Ceramic Society , cilt.106, sa.5, ss.2862-2874, 2023 (SCI-Expanded)

8. Possible boron-rich amorphous silicon borides from ab initio simulations

Karacaoğlan A. Ö. Ç., DURANDURDU M.

Journal of Molecular Modeling , cilt.29, sa.4, 2023 (SCI-Expanded)

9. Boron-rich amorphous boron oxides from ab initio simulations

Karacaoğlan A. Ö. Ç., DURANDURDU M.

Journal of Non-Crystalline Solids , cilt.604, 2023 (SCI-Expanded)

10. Amorphous BC5 from first principles calculations

TAHAOĞLU D., ALKAN F., DURANDURDU M.

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.592, 2022 (SCI-Expanded)

11. Theoretical investigation of substituent effects on the relative stabilities and electronic structure of [BnXn](2-) clusters

JOURNAL OF MOLECULAR MODELING , cilt.27, sa.12, 2021 (SCI-Expanded)

12. Formation of a very high-density amorphous phase of carbon and its crystallization into a simple cubic structure at high pressure

Karacaoglu A. O., DURANDURDU M.

COMPUTATIONAL MATERIALS SCIENCE , cilt.200, 2021 (SCI-Expanded)

13. Amorphous boron phosphide: An ab initio investigation

BOLAT S., Durandurdu M.

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.570, 2021 (SCI-Expanded)

14. Amorphous zircon at high pressure

BOLAT S., DURANDURDU M.

JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS , cilt.153, 2021 (SCI-Expanded)

15. A first principles study of amorphous and crystalline silicon tetraboride

MATERIALS CHEMISTRY AND PHYSICS , cilt.258, 2021 (SCI-Expanded)

16. Stoichiometric amorphous boron carbide (BC)

Yildiz T. A., DURANDURDU M.

JOURNAL OF MATERIALS SCIENCE , cilt.55, sa.30, ss.14709-14716, 2020 (SCI-Expanded)

17. Amorphous silicon hexaboride at high pressure

PHILOSOPHICAL MAGAZINE , cilt.100, sa.14, ss.1818-1833, 2020 (SCI-Expanded)

18. Ab initio simulation of amorphous BC3

Ozlem A., Karacaoglan C., DURANDURDU M.

COMPUTATIONAL MATERIALS SCIENCE , cilt.178, 2020 (SCI-Expanded)

19. Amorphous silicon triboride: A first principles study

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.536, 2020 (SCI-Expanded)

20. High pressure modifications in amorphous boron suboxide: An ab initio study

Yildiz T. A., DURANDURDU M.

CERAMICS INTERNATIONAL , cilt.46, sa.5, ss.5968-5975, 2020 (SCI-Expanded)

21. Amorphous boron carbide from ab initio simulations

COMPUTATIONAL MATERIALS SCIENCE , cilt.173, 2020 (SCI-Expanded)

22. Tetrahedral amorphous boron nitride: A hard material

ERKARTAL M., DURANDURDU M.

JOURNAL OF THE AMERICAN CERAMIC SOCIETY , cilt.103, sa.2, ss.973-978, 2020 (SCI-Expanded)

23. Pressure-induced amorphization, mechanical and electronic properties of zeolitic imidazolate framework (ZIF-8)

MATERIALS CHEMISTRY AND PHYSICS , cilt.240, 2020 (SCI-Expanded)

24. Phase transition of ZrN under pressure

Uchoyuk T. A., DURANDURDU M.

PHILOSOPHICAL MAGAZINE , cilt.99, sa.8, ss.942-955, 2019 (SCI-Expanded)

25. Hydrogenated amorphous boron nitride: A first principles study

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.502, ss.159-163, 2018 (SCI-Expanded)

26. Amorphous zirconia at high pressure

JOURNAL OF THE AMERICAN CERAMIC SOCIETY , cilt.101, sa.12, ss.5411-5418, 2018 (SCI-Expanded)

27. Solute aggregation in Ca72Zn28 metallic glass

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.500, ss.410-416, 2018 (SCI-Expanded)

28. Amorphous magnesium silicide

ERKARTAL M., DURANDURDU M.

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.498, ss.118-124, 2018 (SCI-Expanded)

29. An in-depth investigation of Mg-Zn-Ca metallic glasses: A first principles study

COMPUTATIONAL MATERIALS SCIENCE , cilt.153, ss.326-337, 2018 (SCI-Expanded)

30. Pressure-Induced Amorphization of MOF-5: A First Principles Study

ERKARTAL M., DURANDURDU M.

CHEMISTRYSELECT , cilt.3, sa.28, ss.8056-8063, 2018 (SCI-Expanded)

31. Hard boron rich boron nitride nanoglasses

Cetin A. O., DURANDURDU M.

JOURNAL OF THE AMERICAN CERAMIC SOCIETY , cilt.101, sa.5, ss.1929-1939, 2018 (SCI-Expanded)

32. Permanent densification of amorphous zinc oxide under pressure: A first principles study

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.481, ss.27-32, 2018 (SCI-Expanded)

33. MgCu metallic glass

PHILOSOPHICAL MAGAZINE , cilt.98, sa.8, ss.633-645, 2018 (SCI-Expanded)

34. Amorphous silicon hexaboride: a first-principles study

PHILOSOPHICAL MAGAZINE , cilt.98, sa.30, ss.2723-2733, 2018 (SCI-Expanded)

35. Two successive amorphous-to-amorphous phase transformations in TiO2

JOURNAL OF THE AMERICAN CERAMIC SOCIETY , cilt.100, sa.9, ss.3903-3911, 2017 (SCI-Expanded)

36. Densification of amorphous boron under pressure

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.471, ss.274-279, 2017 (SCI-Expanded)

37. Amorphous zirconia: ab initio molecular dynamics simulations

Philosophical Magazine , cilt.97, sa.16, ss.1334-1345, 2017 (SCI-Expanded)

38. High-density amorphous phase of CdO

Journal of Non-Crystalline Solids , cilt.463, ss.64-67, 2017 (SCI-Expanded)

39. Ferromagnetism in amorphous MgO

PHILOSOPHICAL MAGAZINE , cilt.97, sa.24, ss.2129-2141, 2017 (SCI-Expanded)

40. Nanosegregated amorphous AlBN2 alloy

Philosophical Magazine , cilt.96, sa.30, ss.3200-3210, 2016 (SCI-Expanded)

41. Polyamorphism in Aluminum Nitride: A First Principles Molecular Dynamics Study

JOURNAL OF THE AMERICAN CERAMIC SOCIETY , cilt.99, sa.5, ss.1594-1600, 2016 (SCI-Expanded)

42. n-type conductivity in Si-doped amorphous AlN: an ab initio investigation

PHILOSOPHICAL MAGAZINE , cilt.96, sa.11, ss.1110-1121, 2016 (SCI-Expanded)

43. Pressure-induced phase transformations in amorphous arsenic

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.437, ss.6-9, 2016 (SCI-Expanded)

44. Local structure of As2O3 glass from first principles simulations

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.436, ss.18-21, 2016 (SCI-Expanded)

45. Amorphous boron nitride at high pressure

PHILOSOPHICAL MAGAZINE , cilt.96, sa.18, ss.1950-1964, 2016 (SCI-Expanded)

46. Hexagonal nanosheets in amorphous BN: A first principles study

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.427, ss.41-45, 2015 (SCI-Expanded)

47. Novel high-pressure phase of ZrO2: An ab initio prediction

JOURNAL OF SOLID STATE CHEMISTRY , cilt.230, ss.233-236, 2015 (SCI-Expanded)

48. High-pressure phase transitions of TiN: an ab initio constant pressure study

PHILOSOPHICAL MAGAZINE , cilt.95, sa.22, ss.2376-2384, 2015 (SCI-Expanded)

49. Liquid boron and amorphous boron: An ab initio molecular dynamics study

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.417, ss.10-14, 2015 (SCI-Expanded)

50. Uncovering Nanoclusters in Amorphous AlN: An Ab Initio Study

JOURNAL OF THE AMERICAN CERAMIC SOCIETY , cilt.98, sa.4, ss.1095-1098, 2015 (SCI-Expanded)

51. Atomic structure of amorphous CdO from first principles simulations

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.412, ss.11-15, 2015 (SCI-Expanded)

52. New high-pressure phase of MgH2: An ab initio constant-pressure study

EPL , cilt.105, sa.4, 2014 (SCI-Expanded) Sürdürülebilir Kalkınma

53. Atomic structure of amorphous Mg40Cu35Ti25 alloy: An ab initio molecular dynamics study

SOLID STATE COMMUNICATIONS , cilt.154, ss.30-33, 2013 (SCI-Expanded)

54. Ab initio modeling of metallic Pd80Si20 glass

COMPUTATIONAL MATERIALS SCIENCE , cilt.65, ss.44-47, 2012 (SCI-Expanded)

55. Nanoscale icosahedral packing in amorphous Mg50Ni50: An ab initio study

Tetik E., Durandurdu M., KARADAĞ F.

EPL , cilt.100, sa.2, 2012 (SCI-Expanded)

56. Nanosize icosahedral quasicrystal in Mg90Ca10 glass: An ab initio molecular dynamics study

Ozturkz H., Durandurdu M.

JOURNAL OF CHEMICAL PHYSICS , cilt.137, sa.3, 2012 (SCI-Expanded)

57. Formation of Cotunnite Phase in ZrO2 under Uniaxial Stress: A First Principles Study

JOURNAL OF THE AMERICAN CERAMIC SOCIETY , cilt.94, sa.3, ss.932-937, 2011 (SCI-Expanded)

58. Vibrational properties of amorphous germanium under pressure and its thermal expansion and Gruneisen parameters

Alptekin S., Durandurdu M.

JOURNAL OF NON-CRYSTALLINE SOLIDS , cilt.356, ss.977-981, 2010 (SCI-Expanded)

59. Formation of a Cmcm phase in SnS at high pressure; an ab initio constant pressure study

SOLID STATE COMMUNICATIONS , cilt.150, ss.870-874, 2010 (SCI-Expanded)

60. Formation of Anatase Phase in HfO2 in Tensile Stress: An Ab Initio Study

JOURNAL OF THE AMERICAN CERAMIC SOCIETY , cilt.93, sa.5, ss.1467-1469, 2010 (SCI-Expanded)

61. Ab initio molecular dynamics study of pressure-induced phase transformation in KCl

COMPUTATIONAL MATERIALS SCIENCE , cilt.48, sa.3, ss.672-676, 2010 (SCI-Expanded)

62. Formation of a two-dimensional layered structure in silica under shear stresses: An ab initio study

PHYSICAL REVIEW B , cilt.81, sa.17, 2010 (SCI-Expanded)

63. Orthorhombic intermediate phases for the wurtzite-to-rocksalt phase transformation of CdSe: An ab initio constant pressure study

CHEMICAL PHYSICS , cilt.369, ss.55-58, 2010 (SCI-Expanded)

64. Pressure-induced phase transformation of BaS: An ab initio constant pressure study

Gokoglu G., Durandurdu M., Gulseren O.

CHEMICAL PHYSICS , cilt.367, ss.80-82, 2010 (SCI-Expanded)

65. First principles study of structural phase stability of wide-gap semiconductors MgTe, MgS and MgSe

COMPUTATIONAL MATERIALS SCIENCE , cilt.47, sa.2, ss.593-598, 2009 (SCI-Expanded)

66. Expanded phase of ZrO2: An ab initio constant-pressure study

EPL , cilt.88, sa.6, 2009 (SCI-Expanded)

67. New transformation mechanism for a zinc-blende to rocksalt phase transformation in MgS

JOURNAL OF PHYSICS-CONDENSED MATTER , cilt.21, sa.45, 2009 (SCI-Expanded)

68. Fcc-to-bct phase transformation of aluminum under triaxial stresses: an ab initio constant pressure study

EUROPEAN PHYSICAL JOURNAL B , cilt.72, sa.2, ss.241-245, 2009 (SCI-Expanded)

69. Pressure-induced phase transition in AIN: An ab initio molecular dynamics study

JOURNAL OF ALLOYS AND COMPOUNDS , cilt.480, sa.2, ss.917-921, 2009 (SCI-Expanded)

70. Formation of an anataselike phase in silica under anisotropic stress: An ab initio constant-pressure study

PHYSICAL REVIEW B , cilt.80, sa.2, 2009 (SCI-Expanded)

71. High-density amorphous phase of GeS2 glass under pressure

Oezturk H., Durandurdu M.

PHYSICAL REVIEW B , cilt.79, sa.20, 2009 (SCI-Expanded)

72. High-pressure phases of ZrO2: An ab initio constant-pressure study

PHYSICAL REVIEW B , cilt.79, sa.13, 2009 (SCI-Expanded)

73. The structural phase transition of ZnSe under hydrostatic and nonhydrostatic compressions: an ab initio molecular dynamics study

JOURNAL OF PHYSICS-CONDENSED MATTER , cilt.21, sa.12, 2009 (SCI-Expanded) Sürdürülebilir Kalkınma

74. Pressure-induced phase transition in wurtzite ZnS: An ab initio constant pressure study

ALPTEKIN S., Durandurdu M.

JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS , cilt.70, ss.645-649, 2009 (SCI-Expanded) Sürdürülebilir Kalkınma

75. Pressure-induced phase transition of BeO

SOLID STATE COMMUNICATIONS , cilt.149, ss.345-348, 2009 (SCI-Expanded)

76. An ab initio constant-pressure study of pressure-induced phase transition of MgSe

Oezduran M., Durandurdu M.

EPL , cilt.84, sa.5, 2008 (SCI-Expanded)

77. Pressure-induced phase transition of zinc-blende AlN: An ab initio molecular dynamics study

JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS , cilt.69, sa.11, ss.2894-2897, 2008 (SCI-Expanded)

78. Phase transformation of 6H-SiC at high pressure: An ab initio constant-pressure study

Eker S., Durandurdu M.

EPL , cilt.84, sa.2, 2008 (SCI-Expanded)

79. Diamond to beta-Sn phase transition of silicon under hydrostatic and nonhydrostatic compressions

JOURNAL OF PHYSICS-CONDENSED MATTER , cilt.20, sa.32, 2008 (SCI-Expanded)

80. New B2O3 crystals predicted from concurrent molecular dynamics simulations and first-principles calculations

HUANG L., Durandurdu M., KIEFFER J.

JOURNAL OF PHYSICAL CHEMISTRY C , cilt.111, sa.37, ss.13712-13720, 2007 (SCI-Expanded)

81. Structural phase transition of gold under uniaxial, tensile, and triaxial stresses: An ab initio study

PHYSICAL REVIEW B , cilt.76, sa.2, 2007 (SCI-Expanded)

82. Ab initio simulations of the structural phase transformation of 2H-SiC at high pressure

MARTINEZ I., Durandurdu M.

PHYSICAL REVIEW B , cilt.75, sa.23, 2007 (SCI-Expanded)

83. Transformation pathways of silica under high pressure

HUANG L., Durandurdu M., KIEFFER J.

NATURE MATERIALS , cilt.5, sa.12, ss.977-981, 2006 (SCI-Expanded)

84. Ab initio molecular dynamics study of pressure-induced phase transition in ZnS

JOURNAL OF PHYSICS-CONDENSED MATTER , cilt.18, sa.41, ss.9483-9491, 2006 (SCI-Expanded)

85. Transition pathway in GaAs under uniaxial stress: an ab initio study

JOURNAL OF PHYSICS-CONDENSED MATTER , cilt.18, sa.20, ss.4887-4894, 2006 (SCI-Expanded)

86. Electronic and mechanical properties of wurtzite type SiC nanowires

PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS , cilt.243, sa.5, 2006 (SCI-Expanded)

87. Ab initio modeling of small diameter silicon nanowires

PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS , cilt.243, sa.2, 2006 (SCI-Expanded)

88. Ab initio simulation of polyamorphic phase transition in hydrogenated silicon

PHYSICAL REVIEW B , cilt.73, sa.3, 2006 (SCI-Expanded)

89. Phase transition of GeSe2 at high pressure

PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS , cilt.242, sa.15, ss.3085-3090, 2005 (SCI-Expanded)

90. Cmcm phase of GeS at high pressure

PHYSICAL REVIEW B , cilt.72, sa.14, 2005 (SCI-Expanded)

91. Ab initio simulation of the rhombohedral-to-simple-cubic transition in arsenic

PHYSICAL REVIEW B , cilt.72, sa.7, 2005 (SCI-Expanded)

92. Structural phase transition of germanium under uniaxial stress: An ab initio study

PHYSICAL REVIEW B , cilt.71, sa.5, 2005 (SCI-Expanded)

93. Mechanically controlled, seeded formation of a nanoscale metastable phase in ionic compounds

Palko J., Durandurdu M., Kıeffer J.

NANO LETTERS , cilt.4, sa.9, ss.1769-1773, 2004 (SCI-Expanded)

94. Pressure-induced amorphous-to-amorphous phase transition in GaAs

PHYSICAL REVIEW B , cilt.70, sa.8, 2004 (SCI-Expanded)

95. High-pressure phases of amorphous and crystalline silicon

PHYSICAL REVIEW B , cilt.67, sa.21, 2003 (SCI-Expanded)

96. Pressure-induced structural phase transition of paracrystalline silicon

PHYSICAL REVIEW B , cilt.66, sa.20, 2002 (SCI-Expanded)

97. Ab initio simulation of pressure-induced low-energy excitations in amorphous silicon

PHYSICAL REVIEW B , cilt.66, sa.15, 2002 (SCI-Expanded)

98. Ab initio simulation of high-pressure phases of GaAs

PHYSICAL REVIEW B , cilt.66, sa.4, 2002 (SCI-Expanded)

99. First-order pressure-induced polyamorphism in germanium

Physical Review B - Condensed Matter and Materials Physics , cilt.66, sa.4, ss.412011-412014, 2002 (SCI-Expanded)

100. Simulation of pressure-induced polyamorphism in a chalcogenide glass GeSe2

PHYSICAL REVIEW B , cilt.65, sa.10, 2002 (SCI-Expanded)

101. Ab initio simulation of first-order amorphous-to-amorphous phase transition of silicon

Durandurdu M., DRABOLD D., MOUSSEAU N.

PHYSICAL REVIEW B , cilt.64, sa.1, 2001 (SCI-Expanded)

102. Approximate ab initio calculations of electronic structure of amorphous silicon

PHYSICAL REVIEW B , cilt.62, sa.23, ss.15307-15310, 2000 (SCI-Expanded)

Hakemli Bilimsel Toplantılarda Yayımlanmış Bildiriler 9

1. Derivative Structures of Closo Boron Hydride Cluster, B16X16:A DFT Study

DURANDURDU M., Çetin A. Ö., Üçhöyük T. A.

CSC2018: International Computational Science Congress, 26 - 28 Ekim 2018

2. CMCM INTERMEDIATE PHASE FOR THE HCP-TO-BCC PHASE TRANSITION IN MAGNESIUM

3.ULUSLARARASI MALZEME BİLİMİ VE TEKNOLOJİSİ KONFERANSI (KAPADOKYA), 17 - 19 Eylül 2018

3. Stability Investigation of B16H162- Derivatives by DFT Calculations

International Conference on Materilas Science and Technology in Cappadocia, 17 - 19 Eylül 2018

4. Effects of Production Methods on Structural and Mechanical Properties for Metallic Ca72Zn28 Glass-A DFT Study

The Internatınonal Conference On Materials Science Mechanical And Automation Engineerings And Technology (IMSMATEC’18), 10 - 12 Nisan 2018

5. Polyamorphism in TiO2

ncon-International Congress on Chemistry and Materials Science, 5 - 07 Ekim 2017

6. Metallic Ca72Zn28 Glass from First Principle Molecular Dynamics Simulations

International Congress on Chemistry and Materials Science, Ankara, Türkiye, 5 - 07 Ekim 2017

7. Investigation of Phase Transformation of Amorphous Zinc Oxide under Pressure: a DFT Study

Türk Fizik Derneği 33. Uluslararası Fizik Kongresi, Bodrum, Türkiye, 6 - 10 Eylül 2017

8. POLYAMORPHIC PHASE TRANSITION IN ALUMINUM NITRIDE

Uluslararası Malzeme Bilimi ve Teknolojisi Konferansı Kapadokya (IMSTEC’16), 6 - 08 Nisan 2016

9. Hidden Nanoclusters in Amorphous AlN A First Principles Study