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 | 52 | 2015 |
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 | 48 | 2017 |
Electronic, magnetic, optical and thermoelectric properties of Ca 2 Cr 1− x Ni x OsO 6 double perovskites SR Bhandari, DK Yadav, BP Belbase, M Zeeshan, B Sadhukhan, DP Rai, ... RSC advances 10 (27), 16179-16186, 2020 | 43 | 2020 |
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 | 41 | 2019 |
Electronic structure and elastic properties of ATiO3 (A= Ba, Sr, Ca) perovskites: A first principles study AP Sakhya Indian Journal of Pure & Applied Physics (IJPAP) 53 (2), 102-109, 2015 | 40 | 2015 |
Electronic and magnetic properties of X2YZ and XYZ Heusler compounds: a comparative study of density functional theory with different exchange-correlation potentials DP Rai, A Shankar, AP Sakhya, TP Sinha, R Khenata, MP Ghimire, ... Materials Research Express 3 (7), 075022, 2016 | 38 | 2016 |
Electronic properties and low lattice thermal conductivity (κ l) of mono-layer (ML) MoS 2: FP-LAPW incorporated with spin–orbit coupling (SOC) DP Rai, TV Vu, A Laref, MA Hossain, E Haque, S Ahmad, R Khenata, ... Rsc Advances 10 (32), 18830-18840, 2020 | 35 | 2020 |
Electronic, and thermoelectric properties of half-heusler compounds MCoSb (M= Ti, Zr, Hf): a first principles study H Joshi, DP Rai, A Laref, RK Thapa Materials Research Express 6 (6), 066307, 2019 | 35 | 2019 |
Electronic, optical, and thermoelectric properties of Fe2+ xV1− xAl DP Rai, S Sandeep, A Shankar, R Khenata, AH Reshak, CE Ekuma, ... AIP advances 7 (4), 2017 | 32 | 2017 |
Electronic structure and magnetic properties of X2YZ (X = Co, Y = Mn, Z = Ge, Sn) type Heusler compounds: a first principle study DP Rai, RK Thapa Phase Transitions 85 (7), 608-618, 2012 | 30 | 2012 |
Spin-induced transition metal (TM) doped SnO2 a dilute magnetic semiconductor (DMS): A first principles study DP Rai, A Laref, A Shankar, AP Sakhya, R Khenata, RK Thapa Journal of Physics and Chemistry of Solids 120, 104-108, 2018 | 29 | 2018 |
Electronic structure and elastic properties of scandium carbide and yttrium carbide: A first principles study J Maibam, BI Sharma, R Bhattacharjee, RK Thapa, RKB Singh Physica B: Condensed Matter 406 (21), 4041-4045, 2011 | 29 | 2011 |
An abinitio study of the half-metallic properties of Co2TGe (T=Sc, Ti, V, Cr, Mn, Fe): LSDA+U method DP Rai, RK Thapa Journal of the Korean Physical Society 62, 1652-1660, 2013 | 27 | 2013 |
ELECTRONIC STRUCTURE AND MAGNETIC PROPERTIES OF Co 2 YZ (Y= Cr, Z= Al, Ga) TYPE HEUSLER COMPOUNDS: A FIRST PRINCIPLE STUDY DP Rai, A Shankar, SANDEEP, MP GHIMIRE, RK THAPA International Journal of Modern Physics B 26 (08), 2012 | 27 | 2012 |
GGA and mBJ study of the optoelectronic, magnetic and thermoelectric properties of the SmAlO3 compound with spin–orbit coupling S Chettri, DP Rai, A Shankar, R Khenata, MP Ghimire, RK Thapa, ... International Journal of Modern Physics B 30 (12), 1650078, 2016 | 26 | 2016 |
CALCULATION OF COULOMB REPULSION () U FOR 3d TRANSITION ELEMENTS IN Co2YAl TYPE HEUSLER ALLOYS SJ Hashemifar, MP Ghimire, RK Thapa Armenian Journal of Physics 5 (3), 105-110, 2012 | 26 | 2012 |
Thermoelectric properties of tetragonal half-Heusler compounds, TiXSb (X= Ge, Si): a probe from Density Functional Theory (DFT) H Joshi, DP Rai, KD Verma, KC Bhamu, RK Thapa Journal of Alloys and Compounds 726, 1155-1160, 2017 | 25 | 2017 |
An investigation of semiconducting behavior in the minority spin of Co2CrZ (Z= Ga, Ge, As): LSDA and LSDA+ U method DP Rai, RK Thapa Journal of alloys and compounds 542, 257-263, 2012 | 23 | 2012 |
Ghimire and Lalmuanpuia Indian J RK Thapa, MP Sandeep Phys 85, 727, 2011 | 22 | 2011 |
Investigation of the structural, electronic and optical properties of the cubic RbMF3 perovskites (M= Be, Mg, Ca, Sr and Ba) using modified Becke-Johnson exchange potential DP Rai, A Shankar, MP Ghimire, R Khenata, SB Omran, SV Syrotyuk, ... Materials Chemistry and Physics 192, 282-290, 2017 | 21 | 2017 |