Dr. Ghulam Murtaza

Assistant professor
Islamia College Peshawar, Khyber Pakhtunkhwa, Pakistan

Highest Degree
Ph.D. in Physics from Hazara University Mansehra, Pakistan

My URL
https://livedna.org/92.28982

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Biography

Area of Interest:

Physics
Computational Physics
Optoelectronics
Optical and Electrical Properties
Magnetic Materials

Selected Publications

  1. Shah, S.H., W. Khan, A. Laref and G. Murtaza, 2019. Effects of anion replacement on the physical properties of CaCd2X2 (X= P, As, Sb, Bi). J. Phys. Chem. Solids, 127: 81-87.
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  2. Yousaf, N., W. Khan, S.H. Khan, M. Yaseen, A. Laref and G. Murtaza, 2018. Electronic, optical and thermoelectric properties of SnGa2GeX6 (X = S, Se) compounds. J. Alloys Compounds, 737: 637-645.
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  3. Yousaf, M., J. Munir, M.A. Saeed and G. Murtaza, 2018. Layer-sliding-mediated controlled tuning of physical properties of intercalated silicene/hBN heterostructure. Mater. Res. Express, Vol. 4. .
    Direct Link  |  

  4. Wong, K.M., W. Khan, M. Shoaib, U. Shah, S.H. Khan and G. Murtaza, 2018. Ab initio investigation of the structural, electronic and optical properties of the Li2 In2 XY6 (X= Si, Ge; Y= S, Se) compounds. J. Elect. Mater., 47: 566-576.
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  5. Ullah, M., G. Murtaza and A. Laref, 2018. Electronic band profiles and optical response of Cd3Y2 (Y = N, P and As) compounds. J. Phys. Chem. Solids, 119: 157-165.
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  6. Shah, S.H., S.H. Khan, A. Laref and G. Murtaza, 2018. Optoelectronic and transport properties of LiBZ (B = Al, In, Ga and Z = Si, Ge, Sn) semiconductors. J. Solid State Chem., 258: 800-808.
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  7. Murtaza, G., N. Yousaf, M. Yaseen, A. Laref and S. Azam, 2018. Systematic studies of the structural and optoelectronic characteristics of CaZn2X2M (X = N, P, As, Sb, Bi). Mater. Res. Express, Vol. 5. .
    Direct Link  |  

  8. Murtaza, G., N. Yousaf, A. Laref and M. Yaseen, 2018. Effect of varying pnictogen elements (Pn = N, P, As, Sb, Bi) on the optoelectronic properties of SrZn2Pn2. Zeitschrift Naturforschung A, 73: 285-293.
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  9. Murtaza, G., A.A. Khan, M. Yaseen, A. Laref, N. Ullah and I. ur Rahman, 2018. The effect of replacing pnictogen elements on the physical properties SrMg2 X2 (X + N, P, As, Sb, Bi) Zintl compounds. Chinese Phys. B, Vol. 27. 10.1088/1674-1056/27/4/047102.
    CrossRef  |  Direct Link  |  

  10. Monir, M.E.A., H. Baltach, Y. Mouchaal and G. Murtaza, 2018. The effects of Ru and Rh substitutions on the magneto-electronic and optical properties of the TbNi5 intermetallic compound: An ab initio investigation. J. Superconduct. Novel Magnet., 31: 547-559.
    CrossRef  |  Direct Link  |  

  11. Khan, A.A., M. Yaseen, A. Laref and G. Murtaza, 2018. Impact of anion replacement on the optoelectronic and thermoelectric properties of CaMg2X2, X=(N, P, As, Sb, Bi) compounds. Physica B: Condensed Matter, 541: 24-31.
    CrossRef  |  Direct Link  |  

  12. Khan, A.A., A.U. Rehman, A. Laref, M. Yousaf and G. Murtaza, 2018. Structural, optoelectronic and thermoelectric properties of ternary CaBe2X2 (X= N, P, As, Sb, Bi) compounds. Zeitschrift Naturforschung A, 73: 965-973.
    CrossRef  |  Direct Link  |  

  13. Khan, A., M. Sajjad, G. Murtaza and A. Laref, 2018. Anion-cation replacement effect on the structural and optoelectronic properties of the LiMX2 (M= Al, Ga, In; X= S, Se, Te) Compounds: A first principles study. Zeitschrift Naturforschung A, 73: 645-655.
    Direct Link  |  

  14. Faizan, M., S.H. Khan, A. Khan, A. Laref and G. Murtaza, 2018. Ab-initio prediction of structural, electronic and magnetic properties of Hexafluoromanganete (IV) complexes. Int. J. Modern Phys. B, Vol. 32. 10.1142/S0217979218502703.
    CrossRef  |  Direct Link  |  

  15. Usman, T., G. Murtaza, H. Luo and A. Mahmood, 2017. GGA and GGA+ U study of rare earth-based perovskites in cubic phase. J. Superconduct. Novel Magnet., 30: 1389-1396.
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  16. Ullah, M., G. Murtaza, S.M. Ramay and A.M ahmood, 2017. Structural, electronic, optical and thermoelectric properties of Mg3X2 (X = N, P, As, Sb, Bi) compounds. Mater. Res. Bullet., 91: 22-30.
    CrossRef  |  Direct Link  |  

  17. Shah, S.S.A., A. Khan, S.H. Khan, N. Muhammad, S.A. Khan, M.G. Ashiq and G. Murtaza, 2017. Ab initio study of the electronic and optical properties of Ag3AuS2 polymorphs. Mater. Res. Express, Vol. 4. 10.1088/2053-1591/aa817a.
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  18. Mehmood, N., R. Ahmad and G. Murtaza, 2017. Ab initio investigations of structural, elastic, mechanical, electronic, magnetic and optical properties of half-Heusler compounds RhCrZ (Z = Si, Ge). J. Superconduct. Novel Magnet., 30: 2481-2488.
    CrossRef  |  Direct Link  |  

  19. Khan, S.A., , S. Azam, M.B. Kanoun, G. Murtaza, M. Rani and S. Goumri-Said, 2017. Tailoring the electronic structure and optical properties of cadmium-doped zinc oxides nanosheet. Cogent. Physi., Vol. 4. 10.1080/23311940.2017.1391734.
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  20. Basit, A., G. Murtaza, A. Mahmood, S.A. Khan, M. Aneel, A. Yar and K.M. Wong, 2017. Specific features investigation of the AE2ZnN2 (AE = Ca, Sr, Ba) compounds from indirect to direct band gap: DFT study. Mater. Sci. Semiconduct. Process., 57: 116-123.
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  21. Ali, S., W. Khan, G. Murtaza, M. Yaseen, S.M. Ramay and A. Mahmood, 2017. First principles study of magnetic and electronic properties of A2BB′ O6 (A= Ba, Sr)(BB′= FeRe, MnMo and MnRe) double perovskites. J. Magnet. Magnet. Mater., 441: 113-123.
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  22. Ullah, N., R.Q. Zhang, G. Murtaza, A. Yar and A. Mahmood, 2016. Stacking nature and band gap opening of graphene: Perspective for optoelectronic applications. Solid State Commun., 246: 54-58.
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  23. Ullah, N., G. Murtaza, M.A. Iqbal, A. Mahmood and R. Khenata, 2016. Computational study of Cu2ZnSn (X1− x Te x)4 (X = S, Se) for optoelectronic applications. Int. J. Modern Phys. B, Vol. 30. 10.1142/S021797921650137X.
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  24. Ullah, I., G. Murtaza, R. Khenata, A. Mahmood, M. Muzzamil, N. Amin and M. Saleh, 2016. Structural and optoelectronic properties of X3 ZN (X = Ca, Sr, Ba; Z = As, Sb, Bi) anti-perovskite compounds. J. Elect. Mater., 45: 3059-3068.
    CrossRef  |  Direct Link  |  

  25. Seddik, T., G. Ugur, R. Khenata, S. Ugur and F. Soyalp et al., 2016. Optoelectronic and thermoelectric properties of Zintl YLi3A2 (A = Sb, Bi) compounds through modified Becke-Johnson potential. Chinese Phys. B, Vol. 25. 10.1088/1674-1056/25/10/107801.
    CrossRef  |  Direct Link  |  

  26. Noor, N.A., M. Rashid, S.M. Alay-e-Abbas, M. Raza, A. Mahmood, S.M. Ramay and G. Murtaza, 2016. Shift of indirect to direct bandgap and thermoelectric response of the cubic BiScO3 via DFT-mBJ studies. Mater. Sci. Semiconduct. Process., 49: 40-47.
    CrossRef  |  Direct Link  |  

  27. Naeemullah, G. Murtaza, R. Khenata and S. Bin Omran, 2016. Direct band gap nature and optical response of Bex Mgy Zn1−(x+ y) Se. Modern Phys. Lett. B, Vol. 30. 10.1142/S021798491650007X.
    CrossRef  |  Direct Link  |  

  28. Murtaza, G., M. Ullah, N. Ullah, M. Rani and M. Muzammil et al., 2016. Structural, elastic, electronic and optical properties of bi-alkali antimonides. Bull. Mater. Sci., 39: 1581-1591.
    CrossRef  |  Direct Link  |  

  29. Monir, M.E.A., H. Baltache, G. Murtaza and A. Mehmood, 2016. First-principles Investigation of half-metallicity and ferrimagnet properties of Co2ScZ (Z = As, Sb and Bi). J. Superconduct. Novel Magnet., 29: 501-508.
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  30. Monir, M.A., H. Baltache, R. Khenata, G. Murtaza and A. Mahmood, 2016. Structural, magnetic and optoelectronic properties of TbNi, TbNiTi and TbNiV Compounds. J. Superconduct. Novel Magnet., 29: 1255-1266.
    Direct Link  |  

  31. Khan, W., G. Murtaza, T. Ouahrani, A. Mahmood, R. Khenata, M.E.A. Monir and H. Baltache, 2016. Electronic, bonding, linear and non-linear optical properties of novel Li2Ga2GeS6 compound. J. Alloys Compounds, 674: 109-115.
    CrossRef  |  Direct Link  |  

  32. Hussain, S., G. Murtaza, S.H. Khan, A. Khan and M.A. Ali et al., 2016. First principles study of structural, optoelectronic and thermoelectric properties of Cu2CdSnX4 (X = S, Se, Te) chalcogenides. Mater. Res. Bull., 79: 73-83.
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  33. Faizan, M., S.H. Khan, G. Murtaza, A. Khan and R. Khenata et al., 2016. Structural, elastic, electronic and magnetic properties of Ba2XOsO6 (X = Li, Na, Ca) double perovskites. Indian J. Phys., 90: 1225-1231.
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  34. Faizan, M., G. Murtaza, S.H. Khan, A. Khan, A. Mehmood, R. Khenata and S. Hussain, 2016. First-principles study of the double perovskites Sr2XOsO6 (X = Li, Na, Ca) for spintronics applications. Bull. Mater Sci., 39: 1419-1425.
    CrossRef  |  Direct Link  |  

  35. Faizan, M., G. Murtaza, S. Azam, S.A. Khan, A. Mahmood and A. Yar, 2016. Elastic and optoelectronic properties of novel Ag3AuSe2 and Ag3AuTe2 semiconductors. Mater. Sci. Semiconduct. Process., 52: 8-15.
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  36. El Amine Monir, M., H. Baltache, R. Khenata, G. Murtaza and R. Ahmed et al., 2016. Half-metallicity and optoelectronic properties of V-doped zincblende ZnS and CdS alloys. Int. J. Modern Phys. B, Vol. 30. 10.1142/S021797921650034X.
    CrossRef  |  Direct Link  |  

  37. Dahmane, F., Y. Mogulkoc, B. Doumi, A. Tadjer and R. Khenata et al., 2016. Structural, electronic and magnetic properties of Fe2-based full Heusler alloys: A first principle study. J. Magnet. Magnet. Mater., 407: 167-174.
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  38. Chiker, F., F. Boukabrine, H. Khachai, R. Khenata and C. Mathieu et al., 2016. Investigating the structural, thermal and electronic properties of the zircon-type ZrSiO4, ZrGeO4 and HfSiO4 compounds. J. Elect. Mater., 45: 5811-5821.
    CrossRef  |  Direct Link  |  

  39. Bendjedid, A., H. Baltache, T. Ouahrani, R. Khenata and G. Murtaza et al., 2016. Structural, electronic, bonding and thermo-elastic properties of orthorhombic and cubic CeO2 compound. Chin. J. Phys., 54: 1-11.
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  40. Behram, R.B., M.A. Iqbal, S.M. Alay-e-Abbas, M. Sajjad, M. Yaseen, M.I. Arshad and G. Murtaza, 2016. Theoretical investigation of mechanical, optoelectronic and thermoelectric properties of BiGaO3 and BiInO3 compounds. Mater. Sci. Semiconduct. Process., 41: 297-303.
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  41. Basit, A., S.A. Khan, G. Murtaza, A. Mehmood, R. Khenata, S.B. Omran and M. Yaseen, 2016. Electronic, optical and thermoelectric properties of XNMg3 (X = P, As, Sb, Bi) compounds. Mater. Sci. Semiconduct. Process., 43: 69-74.
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  42. Basit, A., G. Murtaza, A. Mahmood, A. Yar and S. Muhammad, 2016. Structural, optoelectronic and thermoelectric properties of AZn13 (A = Na, K, Ca, Sr, Ba) compounds. Int. J. Modern Phys., B, Vol. 30. 10.1142/S0217979216502210.
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  43. Baki, N., R.D. Eithiraj, H. Khachai, R. Khenata and G. Murtaza et al., 2016. Elastic, electronic, optical and thermal properties of Na2 Po: An Ab Initio study. J. Elect. Mater., 45: 435-443.
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  44. Arif, M., G. Murtaza, R. Ali, R. Khenata, Y. Takagiwa, M. Muzammil and S.B. Omran, 2016. Elastic and electro-optical properties of XYZ (X = Li, Na and K; Y = Mg; Z = N, P, As, Sb and Bi) compounds. Indian J. Phys., 90: 639-647.
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  45. Abid, O.M., S. Menouer, A. Yakoubi, H. Khachai and S.B. Omran et al., 2016. Structural, electronic, elastic, thermoelectric and thermodynamic properties of the NbMSb half heusler (M = Fe, Ru, Os) compounds with first principle calculations. Superlattices Microstruct., 93: 171-185.
    CrossRef  |  Direct Link  |  

  46. Yousaf, M., S.A. Dalhatu, G. Murtaza, R. Khenata and M. Sajjad et al., 2015. Optoelectronic properties of XIn2S4 (X= Cd, Mg) thiospinels through highly accurate all-electron FP-LAPW method coupled with modified approximations. J. Alloys Compounds, 625: 182-187.
    CrossRef  |  Direct Link  |  

  47. Ullah, N., H. Ullah, G. Murtaza, R. Khenata and S. Ali, 2015. Structural phase transition and optoelectronic properties of ZnS under pressure. J. Opt. Adv. Mater, 17: 1272-1277.

  48. Ullah, M., S.A. Khan, G. Murtaza, R. Khenata, N. Ullah and S.B. Omran, 2015. Electronic, thermoelectric and magnetic properties of La2NiMnO6 and La2CoMnO6. J. Magnet. Magnet. Mater., 377: 197-203.
    CrossRef  |  Direct Link  |  

  49. Ullah, H., G. Murtaza, R. Khenata, S. Mohammad and A. Manzar et al., 2015. Mechanical, electronic and magnetic properties of Sm-based perovskite-type oxides SmMO3 (M = V, Fe and Co): An Ab initio study. Indian J. Phys., 89: 1133-1142.
    CrossRef  |  Direct Link  |  

  50. Murtaza, G., N. Ullah, A. Rauf, R. Khenata, S.B. Omran, M. Sajjad and A. Waheed, 2015. First principles study of structural, optical and electronic properties of zinc mercury chalcogenides. Mater. Sci. Semiconduct. Process., 30: 462-468.
    CrossRef  |  Direct Link  |  

  51. Murtaza, G., A. Sajid, M. Rizwan, Y. Takagiwa and H. Khachai et al., 2015. First principles study of Mg2X (X = Si, Ge, Sn, Pb): Elastic, optoelectronic and thermoelectric properties. Mater. Sci. Semiconduct. Process., 40: 429-435.
    CrossRef  |  Direct Link  |  

  52. Moussa, R., A. Abdiche, R. Khenata, D.P. Rai and W.K. Ahmed et al., 2015. Studying structural, electronic and optical properties of zinc-blende Ga1-x Alx P at normal and under pressure by means of first principle. Mater. Res. Express, Vol. 2. 10.1088/2053-1591/2/10/105904.
    CrossRef  |  Direct Link  |  

  53. Moussa, R., A. Abdiche, B. Abbar, M. Guemou and R. Riane et al., 2015. Ab initio investigation of the structural, electronic and optical properties of cubic GaAs1-xPx ternary alloys under hydrostatic pressure. J. Elect. Mater., 44: 4684-4699.
    CrossRef  |  Direct Link  |  

  54. Monir, M.E.A., R. Khenata, H. Baltache, G. Murtaza and M.S. Abu-Jafar et al., 2015. Study of structural, electronic and magnetic properties of CoFeIn and Co2FeIn Heusler alloys. J. Magnet. Magnet. Mater., 394: 404-409.
    CrossRef  |  Direct Link  |  

  55. Monir, M.E.A., R. Khenata, G. Murtaza, H. Baltache and A. Bouhemadou et al., 2015. Half-metallic ferromagnetism in Be1-xVxTe alloys: An Ab-initio study. Indian J. Phys., 89: 1251-1263.
    CrossRef  |  Direct Link  |  

  56. Monir, M.E.A., H. Baltache, R. Khenata, G. Murtaza and S. Azam et al., 2015. First-principles calculations of a half-metallic ferromagnet zinc blende Zn1-xVxTe. J. Magnet. Magnet. Mater., 378: 41-49.
    CrossRef  |  Direct Link  |  

  57. Louhab, H., A. Yakoubi, H. Khachai, O.M. Abid and R. Khenata et al., 2015. First-principles study of structural, electronic, elastic and thermal properties of intermetallic ternary compounds (RMn2Si2: R = Ce and Nd). Mater. Sci. Semiconduct. Process., 38: 31-40.
    CrossRef  |  Direct Link  |  

  58. Khalfa, M., H. Khachai, F. Chiker, N. Baki and K. Bougherara et al., 2015. Mechanical, electronic and thermodynamic properties of full Heusler compounds Fe2VX (X = Al, Ga). Int. J. Modern Phys. B, Vol. 29. 10.1142/S021797921550229X.
    CrossRef  |  Direct Link  |  

  59. Harmel, M., H. Khachai, A. Haddou, R. Khenata and G. Murtaza et al., 2015. Ab initio study of the mechanical, thermal and optoelectronic properties of the cubic CsBaF3. Acta Phys. Pol., 128: 34-42.
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  60. Hafeez, R., G. Murtaza, R. Khenata, K. Wong and S. Naeem et al., 2015. Structural, chemical bonding, electronic and magnetic properties of XY3 (X = Al, Ga and Y = V, Nb, Cr, Mo) compounds. Acta Phys. Polonica A, 127: 770-779.
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  61. Haddou, A., G. Murtaza, H. Khachai, R. Khenata and S. Bin Omran et al., 2015. Structural, elastic, electronic optical and thermodynamic properties of ZnAl2S4. Int. J. Thermophys., 36: 2940-2952.

  62. Fahad, S., G. Murtaza, T. Ouahrani, R. Khenata, M. Yousaf, S.B. Omran and S. Mohammad, 2015. Structural, elastic, electronic, bonding and optical properties of BeAZ2 (A = Si, Ge, Sn; Z = P, As) chalcopyrites. J. Alloys Compounds, 646: 211-222.
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  63. Elahmar, M.H., H. Rached, D. Rached, R. Khenata, G. Murtaza, S.B. Omran and W.K. Ahmed, 2015. Structural, mechanical, electronic and magnetic properties of a new series of quaternary Heusler alloys CoFeMnZ (Z = Si, As, Sb): A first-principle study. J. Magnet. Magnet. Mater., 293: 165-174.
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  64. El-Kelma, R.Z., L. Beldi, F. El Haj Hassan, G. Murtaza and R. Khenata et al., 2015. Magnetic ordering and electronic structure of the ternary iron arsenide BaFe2As2. Int. J. Modern Phys. B, Vol. 29. 10.1142/S0217979215501829.
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  65. Djied, A., T. Seddik, O. Merabiha, G. Murtaza and R. Khenata et al., 2015. Structural phase transition and opto-electronic properties of NaZnAs. J. Alloys Compounds, 622: 812-818.
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  66. Benkaddour, I., H. Khachai, F. Chiker, N. Benosman and Y. Benkaddour et al., 2015. Ab initio study of the structural, electronic and thermal properties of BaS1-xTex alloy. Int. J. Thermophys., 36: 1640-1653.
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  67. Bendjedid, A., T. Seddik, R. Khenata, H. Baltache and G. Murtaza et al., 2015. GGA+ U study on phase transition, optoelectronic and magnetic properties of AmO2 with spin-orbit coupling. J. Magnet. Magnet. Mater., 396: 190-197.
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  68. Belkhouane, M., S. Amari, A. Yakoubi, A. Tadjer and S. Mecabih et al., 2015. First-principles study of the electronic and magnetic properties of Fe2MnAl, Fe2MnSi and Fe2MnSi0.5Al0.5. J. Magnet. Magnet. Mater., 377: 211-214.
    CrossRef  |  Direct Link  |  

  69. Azam, S., S.A. Khan, W. Khan, S. Muhammad and H. Udin et al., 2015. Detailed DFT studies of the electronic structure and optical properties of KBaMSe3 (M = As, Sb). J. Alloys Compounds, 644: 91-96.
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  70. Azam, S., S.A. Khan, R. Khenata, G. Murtaza, S.B. Omran and S. Muhammad, 2015. Optoelectronic and magnetic properties of Eu2Si5N8: An Ab-initio study. Zeitschrift Naturforschung A, 70: 897-904.
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  71. Azam, S., S.A. Khan, J. Minar, W. Khan and H.U. Din et al., 2015. Coulomb interaction and spin-orbit coupling calculations of thermoelectric properties of the quaternary chalcogenides Tl2PbXY4 (X = Zr, Hf and Y = S, Se). Semiconduct. Sci. Technol., Vol. 30. 10.1088/0268-1242/30/10/105018.
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  72. Arar, R., T. Ouahrani, D. Varshney, R. Khenata and G. Murtaza et al., 2015. Structural, mechanical and electronic properties of sodium based fluoroperovskites NaXF3 (X = Mg, Zn) from first-principle calculations. Mater. Sci. Semiconduct. Process., 33: 127-135.
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  73. Ali, M.A., A. Khan, S.H. Khan, T. Ouahrani, G. Murtaza, R. Khenata and S.B. Omran, 2015. First principles study of Cu based delafossite transparent conducting oxides CuXO2 (X = Al, Ga, In, B, La, Sc, Y). Mater. Sci. Semiconduct. Process., 38: 57-66.
    CrossRef  |  Direct Link  |  

  74. Ahmad, M., G. Murtaza, R. Khenata, S.B. Omran and A. Bouhemadou, 2015. Structural, elastic, electronic, magnetic and optical properties of RbSrX (C, SI, Ge) half-Heusler compounds. J. Magnet. Magnet. Mater., 377: 204-210.
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  75. Abdiche, A., R. Riane, M. Guemou, R. Khenata, R. Moussa, G. Murtaza and S.B. Omran, 2015. First principle study of structural and electronic properties of cubic quaternary BxGa1-xAs1-yNy alloys. Solid State Commun., 206: 56-64.
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  76. Bouhemadou, R.K., S. Bin-Omran, G. Murtaza and Y. Al-Douri, 2015. Structural, elastic, electronic and optical properties of new layered semiconductor BaGa2P2. Opt. Mater., 46: 122-130.
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  77. Yousaf, M., F. Inam, R. Khenata, G. Murtaza, A.R.M. Isa and M.A. Saeed, 2014. Prediction study of structural, electronic and optical properties of XIn2S4 (X = Hg, Zn) thiospinels under pressure effect. J. Alloys Compounds, 589: 353-363.
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  78. Ullah, S.,. Ud Din, G. Murtaza, T. Ouahrani, R. Khenata, Naeemullah and S. Bin Omran, 2014. Structural, electronic and optical properties of AgXY2(X = Al, Ga, In and Y = S, Se, Te). J. Alloys Compounds, 617: 575-583.

  79. Ullah, N., G. Murtaza, R. Khenata, K.M. Wong and Z.A. Alahmed, 2014. Phase transition, electronic and optical properties of mercury chalcogenides under pressure. Phase Trans., 87: 571-581.
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  80. Ullah, N., G. Murtaza, R. Khenata, J. Rehman, H.U. Din and S.B. Omran, 2014. Structural, chemical bonding and optoelectronic properties of Mg doped zinc chalcogenides: A first principles study. Mater. Sci. Semiconduct. Process., 26: 681-689.
    CrossRef  |  Direct Link  |  

  81. Ullah, H., A.H. Reshak, K. Inayat, R. Ali and G. Murtaza et al., 2014. Structural, elastic, optoelectronic and optical properties of CuX (X = F, Cl, Br, I): A DFT study. J. Optoelect. Adv. Mater., 16: 1493-1502.

  82. Sajid, A., S. Ullah, G. Murtaza, R. Khenata, A. Manzar and S.B. Omran, 2014. Electronic structure and optical properties of chalcopyrite CuYZ2 (Y = Al Ga In; Z = S Se): An ab initio study. J. Opto. Adv. Mat., 16: 76-81.

  83. Naeemullah, G. Murtaza, R. Khenata, Z.A. Alahmed and A.H. Reshak, 2014. Phase transition, electronic and optical properties of NaCl under pressure. Modern Phys. Lett. B, Vol. 28. 10.1142/S0217984914500626.
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  84. Naeemullah, G. Murtaza, R. Khenata, Mazharullah and S.B. Omran, 2014. Phase transition, electronic and optical properties of III-Sb compounds under pressure. Phase Trans., 87: 893-906.
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  85. Naeemullah, G. Murtaza, R. Khenata, A.H. Reshak, S. Naeem and M.N. Khalid, 2014. Insulator to metal transition and optical response of CsCl under pressure. Int. J. Modern Phys. B, Vol. 28. 10.1142/S0217979214500477.
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  86. Murtaza, G., S.K. Gupta, T. Seddik, R. Khenata and Z.A. Alahmed et al., 2014. Structural, electronic, optical and thermodynamic properties of cubic REGa3 (RE = Sc or Lu) compounds: Ab initio study. J. Alloys Compounds, 597: 36-44.
    CrossRef  |  Direct Link  |  

  87. Murtaza, G., R. Sibghat-Ullah, A.H. Khenata, A.H. Reshak and S.S. Hayat, 2014. Optoelectronic properties of XYAs2 (X = Zn, Cd; Y = Si, Sn) chalcopyrite compounds. J. Optoelect. Adv. Mater., 16: 110-116.

  88. Murtaza, G., R. Khenata, S. Muhammad, A.H. Reshak, K.M. Wong, S.B. Omran and Z.A. Alahmed, 2014. Structural, chemical bonding, electronic and magnetic properties of KMF3 (M = Mn, Fe, Co, Ni) compounds. Comput. Mater. Sci., 85: 402-408.
    CrossRef  |  Direct Link  |  

  89. Murtaza, G., R. Khenata, N. Hassan, S. Naeem, M.N. Khalid and S.B. Omran, 2014. Structural and optoelectronic properties of PbSxSe1− x, PbSxTe1− x and PbSexTe1− x via first-principles calculations. Comput. Mater. Sci., 83: 496-503.
    CrossRef  |  Direct Link  |  

  90. Murtaza, G., R. Khenata, A.H. Reshak, S.S. Hayat and S.B. Omran, 2014. Towards from indirect to direct band gap and optical properties of XYP2 (X = Zn, Cd; Y = Si, Ge, Sn). Phys. B: Condensed Matter, 441: 94-99.
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  91. Murtaza, G., R. Khenata, A. Safeer, Z.A. Alahmed and S.B. Omran, 2014. Shift of band gap from indirect to direct and optical response of CaO by doping S, Se, Te. Comput. Mater. Sci., 91: 43-49.
    CrossRef  |  Direct Link  |  

  92. Murtaza, G., R. Khenata and A.H. Reshak, 2014. Electronic, optical and bonding properties of MgYZ2 (Y = Si, Ge; Z = N, P) chalcopyrites from first principles. Mater. Sci. Semiconduct. Process., 26: 79-86.
    CrossRef  |  Direct Link  |  

  93. Missoum, A., T. Seddik, G. Murtaza, R. Khenata and A. Bouhemadou et al., 2014. Ab initio study of the structural and optoelectronic properties of the half-Heusler CoCr Z (Z= Al, Ga). Canadian J. Phys., 92: 1105-1112.
    Direct Link  |  

  94. Merabiha, O., T. Seddik, R. Khenata, G. Murtaza and A. Bouhemadou et al., 2014. The effects of 5f localization on the electronic and magnetic properties of the hexagonal U3ZrSb5. J. Alloys Compounds, 586: 529-535.
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  95. Manzar, A., G. Murtaza, R. Khenata, M. Yousaf and S. Muhammad, 2014. Electronic and optic properties of cubic spinel CdX2O4 (X = In, Ga, Al) through modified Becke-Johnson potential. Chinese Phys. Lett., Vol. 31. 10.1088/0256-307X/31/6/067401.
    CrossRef  |  Direct Link  |  

  96. Litimein, F., R. Khenata, S.K. Gupta, G. Murtaza and A.H. Reshak et al., 2014. Structural, electronic and optical properties of orthorhombic and triclinic BiNbO4 determined via DFT calculations. J. Mater. Sci., 49: 7809-7818.
    CrossRef  |  Direct Link  |  

  97. Jibran, M., G. Murtaza, M.A. Khan, R. Khenata, S. Muhmmad and R. Ali, 2014. First principle study of MF2 (M = Mg, Ca, Sr, Ba, Ra) compounds. Comput. Mater. Sci., 81: 575-581.
    CrossRef  |  Direct Link  |  

  98. El Amine Monir, M., H. Baltache, G. Murtaza, R. Khenata and S. Bin Omran et al., 2014. Ab initio study of structural, electronic, magnetic and optical properties of Ti-doped ZnTe and CdTe. Int. J. Modern Phys. B, Vol. 28. 10.1142/S0217979214500805.
    CrossRef  |  Direct Link  |  

  99. Djied, A., H. Khachai, T. Seddik, R. Khenata and A. Bouhemadou et al., 2014. Structural phase transition, mechanical and optoelectronic properties of the tetragonal NaZnP: Ab-initio study. Comput. Mater. Sci., 84: 396-403.
    CrossRef  |  Direct Link  |  

  100. Djaafri, T., A. Djaafri, A. Elias, G. Murtaza and R. Khenata et al., 2014. Investigations of the half-metallic behavior and the magnetic and thermodynamic properties of half-Heusler CoMnTe and RuMnTe compounds: A first-principles study. Chinese Phys. B, Vol. 23. 10.1088/1674-1056/23/8/087103.
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  101. Ali, R., G. Murtaza, Y. Takagiwa, R. Khenata, H. Uddin, H. Ullah and S.A. Khan, 2014. Optoelectronic properties, elastic moduli and thermoelectricity of SrAlGa: An Ab initio study. Chinese Phys. Lett., Vol. 31. 10.1088/0256-307X/31/4/047102.
    CrossRef  |  Direct Link  |  

  102. Abid, O.M., A. Yakoubi, A. Tadjer, R. Khenata and R. Ahmed et al., 2014. Ab initio study of the structural, electronic, elastic and thermal properties of RMn2Ge2 (R = Ca, Nd and Y) intermetallic compounds. J. Alloys Compounds, 616: 475-482.
    CrossRef  |  Direct Link  |  

  103. Shoaib, M., G. Murtaza, R. Khenata, M. Farooq and R. Ali, 2013. Structural, elastic, electronic and chemical bonding properties of AB (A = Sc, Y, La; B = N, P, As, Sb, Bi) from first principles. Comput. Mater. Sci., 79: 239-246.
    CrossRef  |  Direct Link  |  

  104. Semari, F., T. Ouahrani, H. Khachai, R. Khenata and M. Rabah et al., 2013. Electronic band structure, optical, thermal and bonding properties of X Mg2O4 (X = Si, Ge) spinel compounds. Int. J. Modern Phys. B, Vol. 27. 10.1142/S0217979213500823.
    CrossRef  |  Direct Link  |  

  105. Sajid, A., G. Murtaza and A.H. Reshak, 2013. Shift of band gap from direct to indirect and optical response of LiF under pressure. Modern Phys. Lett. B, Vol. 27. 10.1142/S0217984913500619.
    CrossRef  |  Direct Link  |  

  106. Naeem, S., G. Murtaza, R. Khenata and M.N. Khalid, 2013. First principle study of CsSrM3 (M = F, Cl). Physica B: Condensed Matter, 414: 91-96.
    CrossRef  |  Direct Link  |  

  107. Murtaza, G., R. Khenata, S. Naeem, M.N. Khalid and S. Mohammad, 2013. First principle calculations of the ground and excited state properties of RbPbF3. Chinese Phys. Lett., Vol. 30. 10.1088/0256-307X/30/9/097101.
    CrossRef  |  Direct Link  |  

  108. Murtaza, G., R. Khenata, M.N. Khalid and S. Naeem, 2013. Elastic and optoelectronic properties of RbMF3 (M = Zn, Cd, Hg): A mBJ density functional calculation. Physica B: Condensed Matter, 410: 131-136.
    CrossRef  |  Direct Link  |  

  109. Murtaza, G., I. Ahmad and A. Afaq, 2013. Shift of indirect to direct bandgap in going from K to Cs in MCaF3 (M = K, Rb, Cs). Solid State Sci., 16: 152-157.
    CrossRef  |  Direct Link  |  

  110. Manzar, A., G. Murtaza, R. Khenata and S. Muhammad, 2013. Electronic band structure and optical response of spinel SnX2O4 (X = Mg, Zn) through Modified Becke-Johnson potential. Chinese Phys. Lett., Vol. 30. 10.1088/0256-307X/30/4/047401.
    CrossRef  |  Direct Link  |  

  111. Manzar, A., G. Murtaza, R. Khenata and S. Muhammad, 2013. Electronic band profile and optical response of spinel MgIn2O4 through modified Becke-Johnson potential. Chinese Phys. Lett., Vol. 30. 10.1088/0256-307X/30/6/067401.
    CrossRef  |  Direct Link  |  

  112. Manzar, A., G. Murtaza, R. Khenata and S. Muhammad, 2013. Electronic and optical properties of spinel GeMg2O4 and GeCd2O4. Chinese Phys. Lett., Vol. 30. 10.1088/0256-307X/30/12/127401.
    CrossRef  |  Direct Link  |  

  113. Hayatullah, G. Murtaza, R. Khenata, S. Mohammad, S. Naeem, M.N. Khalid and A. Manzar, 2013. First principles calculations of ground and excited state properties of CsMCl3 (M = Zn, Cd). Physica B: Condensed Matter, 420: 15-23.

  114. Haddou, A., H. Khachai, R. Khenata, F. Litimein and A. Bouhemadou et al., 2013. Elastic, optoelectronic and thermal properties of cubic CSi2N4: An ab initio study. J. Mater. Sci., 48: 8235-8243.
    CrossRef  |  Direct Link  |  

  115. Ayatullahah, H., G. Murtaza, S. Muhammad, S. Naeem, M.N. Khalid and A. Manzar, 2013. Physical properties of CsSnM3 (M= Cl, Br, I): A first principle study. Acta Phys. Polym., 124: 102-107.
    Direct Link  |  

  116. Ali, R., R. Khanata, B. Amin, G. Murtaza and S. Bin Omran, 2013. Structural, elastic, electronic, chemical bonding and optical properties of M 2 Se (M = Li, Na, K, Rb) through first principle study. Int. J. Modern Phys. B, Vol. 27. 10.1142/S0217979213501701.
    CrossRef  |  Direct Link  |  

  117. Ali, M., S. Mohammad, M. Haneef, M. Khan and G. Murtaza, 2013. Opto-electronic response of Spinel SiZn2O4 to a modified Becke-Johnson potential. J. Korean Phys. Soc., 63: 961-964.
    CrossRef  |  Direct Link  |  

  118. Murtaza, G., B. Amin, S. Arif, M. Maqbool and I. Ahmad et al., 2012. Structural, electronic and optical properties of CaxCd1− xO and its conversion from semimetal to wide bandgap semiconductor. Comput. Mater. Sci., 58: 71-76.
    CrossRef  |  Direct Link  |  

  119. Murtaza, G. and I. Ahmad, 2012. Shift of indirect to direct bandgap and optical response of LaAlO3 under pressure. J. Applied Phys., Vol. 111. 10.1063/1.4729264.
    CrossRef  |  Direct Link  |  

  120. Ahmad, I., B. Amin, M. Maqbool, S. Muhammad, G. Murtaza, S. Ali and N.A. Noor, 2012. Optoelectronic response of GeZn2O4 through the modified becke-Johnson potential. Chinese Phys. Lett., Vol. 29. 10.1088/0256-307X/29/9/097102.
    CrossRef  |  Direct Link  |  

  121. Murtaza, G., I. Ahmad, M. Maqbool, H.R. Aliabad and A. Afaq, 2011. Structural and optoelectronic properties of cubic CsPbF3 for novel applications. Chinese Phys. Lett., Vol. 28. 10.1088/0256-307X/28/11/117803.
    CrossRef  |  Direct Link  |  

  122. Murtaza, G., I. Ahmad, B. Amin, M. Saddique, N. Khalid and S. Naeem, 2011. First principles study of on the structural, electronic and optical properties of cubic AgTF3 (T:Mg, Zn). Physica B: Condensed Matter, 406: 2509-2514.
    Direct Link  |  

  123. Murtaza, G., I. Ahmad, B. Amin, A. Afaq, F. Ghafoor and A. Benamrani, 2011. Linear and nonlinear optical response of MgxZn1− xO: A density functional study. Physica B: Condensed Matter, 406: 2632-2636.
    CrossRef  |  Direct Link  |  

  124. Murtaza, G., I. Ahmad, B. Amin, A. Afaq and M. Maqbool et al., 2011. Investigation of structural and optoelectronic properties of BaThO3. Opt. Mater., 33: 553-557.
    CrossRef  |  Direct Link  |  

  125. Murtaza, G. and I. Ahmad, 2011. First principle study of the structural and optoelectronic properties of cubic perovskites CsPbM3 (M = Cl, Br, I). Phys. B: Condensed Matter, 406: 3222-3229.
    CrossRef  |  Direct Link  |  

  126. Khan, I., I. Ahmad, B. Amin, G. Murtaza and Z. Ali, 2011. Bandgap engineering of Cd1− xSrxO. Phys. B: Condensed Matter, 406: 2509-2514.
    CrossRef  |  Direct Link  |  

  127. Ali, Z., I. Ahmad, B. Amin, M. Maqbool and G. Murtaza et al., 2011. Theoretical studies of structural and magnetic properties of cubic perovskites PrCoO3 and NdCoO3. Physica B: Condensed Matter, 406: 3800-3804.
    CrossRef  |  Direct Link  |  
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