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Dibya Prakash Rai
Dibya Prakash Rai
Associate Professor Mizoram University
Adresă de e-mail confirmată pe mzu.edu.in - Pagina de pornire
Titlu
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Electronic, optical and thermoelectric investigations of Zintl phase AE3AlAs3 (AE= Sr, Ba): first-principles calculations
A Bekhti-Siad, K Bettine, DP Rai, Y Al-Douri, X Wang, R Khenata, ...
Chinese journal of physics 56 (3), 870-879, 2018
1392018
Theoretical prediction of electronic, transport, optical, and thermoelectric properties of Janus monolayers In2XO (X = S, Se, Te)
DP Rai
PHYSICAL REVIEW B 103, 085422, 2021
1292021
First-principles computations of As-ternary alloys: a study on structural, electronic, optical and elastic properties
S Touam, R Belghit, R Mahdjoubi, Y Megdoud, H Meradji, MS Khan, ...
Bulletin of Materials Science 43 (1), 22, 2020
1172020
Hexagonal boron nitride (h-BN) nanosheet as a potential hydrogen adsorption material: A density functional theory (DFT) study
B Chettri, PK Patra, NN Hieu, DP Rai
Surfaces and Interfaces 24, 101043, 2021
942021
A theoretical investigation of the lead‐free double perovskites halides Rb2XCl6 (X = Se, Ti) for optoelectronic and thermoelectric applications
S Al‐Qaisi, AM Mebed, M Mushtaq, DP Rai, TA Alrebdi, RA Sheikh, ...
Journal of computational chemistry 44 (19), 1690-1703, 2023
912023
First-principles investigation of structural, elastic, thermodynamic, electronic and optical properties of lead-free double perovskites halides: Cs2LiYX6 (X= Br, I)
S Al-Qaisi, DP Rai, BU Haq, R Ahmed, TV Vu, M Khuili, SA Tahir, ...
Materials Chemistry and Physics 258, 123945, 2021
892021
Structural, electronic and magnetic properties of Fe2-based full Heusler alloys: A first principle study
F Dahmane, Y Mogulkoc, B Doumi, A Tadjer, R Khenata, SB Omran, ...
Journal of Magnetism and Magnetic Materials 407, 167-174, 2016
802016
The electronic, magnetic and optical properties of double perovskite A2FeReO6 (A= Sr, Ba) from first principles approach
DP Rai, A Shankar, MP Ghimire, RK Thapa
Computational Materials Science 101, 313-320, 2015
802015
Doping-Induced Half-Metallic Ferromagnetism in Vanadium and Chromium-Doped Alkali Oxides K2O and Rb2O: Ab Initio Method
ME Amine Monir, H Baltach, A Abdiche, Y Al-Douri, R Khenata, SB Omran, ...
Journal of Superconductivity and Novel Magnetism 30, 2197-2210, 2017
742017
Electronic and optical properties of bulk and surface of CsPbBr3 inorganic halide perovskite a first principles DFT 1/2 approach
M Ezzeldien, S Al-Qaisi, ZA Alrowaili, M Alzaid, E Maskar, A Es-Smairi, ...
Scientific Reports 11 (1), 20622, 2021
672021
A promising thermoelectric response of HfRhSb half Heusler compound at high temperature: a first principle study
K Kaur, R Kumar, DP Rai
Journal of Alloys and Compounds 763, 1018-1023, 2018
662018
Structural, elastic, thermodynamic, electronic, optical and thermoelectric properties of MgLu2X4 (X= S, Se) spinel compounds from ab-initio calculations
DP Rai
Materials Science in Semiconductor Processing 128 (13), 105766, 2021
602021
First-principles calculations of rare earth (RE= Tm, Yb, Ce) doped ZnO: Structural, optoelectronic, magnetic, and electrical properties
M Khuili, N Fazouan, H Abou El Makarim, EH Atmani, DP Rai, M Houmad
Vacuum 181, 109603, 2020
592020
Electronic, magnetic, optical and thermoelectric properties of Ca2Cr1xNixOsO6 double perovskites
DP Rai
RSC Advances 10, 16179, 2020
582020
Study of the enhanced electronic and thermoelectric (TE) properties of Zr x Hf 1− x− y Ta y NiSn: a first principles study
DP Rai, A Shankar, MP Ghimire, R Khenata, RK Thapa
RSC Advances 5 (115), 95353-95359, 2015
572015
Electronic and optical properties of cubic SrHfO3 at different pressures: a first principles study
DP Rai, A Shankar, AP Sakhya, TP Sinha, B Merabet, R Khenata, ...
Materials Chemistry and Physics 186, 620-626, 2017
552017
Structural, electronic, mechanical, and thermoelectric properties of a novel half Heusler compound HfPtPb
K Kaur, DP Rai, RK Thapa, S Srivastava
Journal of Applied Physics 122 (4), 2017
522017
A comprehensive first-principles computational study on the physical properties of lutetium aluminum perovskite LuAlO3
S Al-Qaisi, R Ahmed, BU Haq, DP Rai, SA Tahir
Materials Chemistry and Physics 250, 123148, 2020
512020
A theoretical analysis of elastic and optical properties of half Heusler MCoSb (M= Ti, Zr and Hf)
H Joshi, DP Rai, L Hnamte, A Laref, RK Thapa
Heliyon 5 (3), 2019
512019
A comparative study of a Heusler alloy Co2FeGe using LSDA and LSDA+ U
DP Rai, A Shankar, MP Ghimire, RK Thapa
Physica B: Condensed Matter 407 (18), 3689-3693, 2012
512012
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