A. Shankar

发表

Tailoring energy band gap and optical absorption of Cd doped MnTe2

K. Neupane, B. Thapa, P. K. Patra, 2020 .

Electronic, optical and thermoelectric properties of bulk and surface (001) CuInTe2: A first principles study

Sandeep, Anup Pradhan Sakhya, R. Thapa, 2017 .

A first principles study on the ground state properties of three ferromagnetic skutterudites NdB4As12 (B = Fe, Ru, Os)

P. Mandal, A. Shankar, T. Chaki, 2019, Materials Research Express.

Electronic, magnetic and structural properties of the filled skutterudite EuFe4P12: LSDA and LSDA+U calculation

R. Thapa, A. Shankar, 2013 .

Ground state properties of filled skutterudite EuRu4P12: A first principles study

Sandeep, R. Thapa, D. P. Rai, 2013 .

Pressure-Induced Enhanced Optical Absorption in Sulvanite Compound Cu3TaX4 (X = S, Se, and Te): An ab Initio Study

A. Laref, S. Chatterjee, H. Joshi, 2022, ACS omega.

First-Principles Study of the Structural, Electronic, Magnetic and Thermal Properties of the Cr Doped Ge6Mn2Te8 and Ge6Fe2Te8 Systems

A. Bouhemadou, D. P. Rai, R. Khenata, 2017 .

Electronic and optical properties of cubic SrHfO3 at different pressures: A first principles study

Sandeep, Anup Pradhan Sakhya, B. Merabet, 2017 .

Effect of Fe-Ru doping in the electronic and thermoelectric properties of new filled skutterudite Ba(Fe,Ru)4As12

Sandeep, R. Thapa, D. P. Rai, 2017 .

Electronic structure and thermoelectricity of filled skutterudite CeRu4Sb12

Sandeep, R. Thapa, D. P. Rai, 2016 .

First principle study of the perspective thermoelectric material LnFe4Sb12 (Ln = La- Nd, Sm-Tb, Yb)

A. Shankar, A. Saxena, N. Limbu, 2022, Computational Materials Science.

Half-metallicity in new Heusler alloys Mn2ScZ (Z = Si, Ge, Sn)

A. Saxena, A. Shankar, M. Ram, 2020, RSC advances.

Modulation of the Optoelectronic Properties of Cdse2

B. Thapa, P. K. Patra, A. Shankar, 2022, SSRN Electronic Journal.

Enhanced electronic and thermoelectric properties of p-type doped filled skutterudites RFe4Sb12 (R = Pr, Nd)

H. Joshi, R. Khenata, A. Shankar, 2020 .

Electronic and Magnetic Properties of Fe Atomic Chain and Fe Atomic Plane: An ab initio Study

Sandeep, R. Thapa, D. P. Rai, 2017, International Journal of Nanoscience.

Electronic structure and thermoelectricity of filled skutterudite EuRu4As12: a DFT calculation

Sandeep, R. Thapa, D. P. Rai, 2017 .

X-dependence of energy band structures and thermoelectricity of CeRu4X12 (X = P, As, Sb)

R. Thapa, P. Mandal, A. Shankar, 2017, Journal of Materials Science.

Energy Bands and Thermoelectricity of Filled Skutterudite $$\mathrm{EuRu}_{4}\mathrm{As}_{12}$$EuRu4As12

Sandeep, R. Thapa, D. P. Rai, 2016 .

FP-LAPW calculations of the elastic, electronic and thermoelectric properties of the filled skutterudite CeRu4Sb12

R. Thapa, D. P. Rai, R. Khenata, 2016 .

A First Principles Calculation of Ferromagnetic EuFe4Sb12

Sandeep, R. Thapa, D. P. Rai, 2014 .

A comparative study of a Heusler alloy Co2FeGe using LSDA and LSDA+U

Sandeep, R. Thapa, D. P. Rai, 2012 .

Structural, electronic, magnetic and optical properties of neodymium chalcogenides using LSDA+U method

R. Thapa, D. P. Rai, A. Shankar, 2012 .

Magnetic and electronic properties of half-metallic NiTbSb: a first principles study

Sandeep, R. Thapa, D. P. Rai, 2012 .

Study of the structural properties of Co2YGe (Y=Sc, Ti, V, Cr, Mn, Fe) by GGA method

Sandeep, R. Thapa, D. P. Rai, 2012 .

A First Principles Study

A. K. Mohanty, A. Shankar, Arthur Ernst, 2012 .

Spin-induced transition metal (TM) doped SnO 2 a dilute magnetic semiconductor (DMS): A first principles study

Sandeep, Anup Pradhan Sakhya, R. Thapa, 2018, Journal of Physics and Chemistry of Solids.

Study of the enhanced electronic and thermoelectric (TE) properties of ZrxHf1−x−yTayNiSn: a first principles study

Sandeep, R. Thapa, D. P. Rai, 2015 .

The electronic, magnetic and optical properties of double perovskite A2FeReO6 (A = Sr, Ba) from first principles approach

Sandeep, R. Thapa, D. P. Rai, 2015 .

Electronic, optical, and thermoelectric properties of Fe2+xV1−xAl

Sandeep, R. Thapa, D. P. Rai, 2017 .

Electronic and magnetic properties of X2YZ and XYZ Heusler compounds: a comparative study of density functional theory with different exchange-correlation potentials

Sandeep, Anup Pradhan Sakhya, R. Thapa, 2016 .

First-Principle Calculations of Structural, Elastic, and Electronic Properties of Intermetallic Rare Earth R2Ni2Pb (R = Ho, Lu, and Sm) Compounds

K. D. Verma, Y. Al-Douri, C. Voon, 2017, Journal of Superconductivity and Novel Magnetism.

Study of electronic and the thermoelectric properties of Gd filled skutterudites

R. Thapa, A. Saxena, A. Shankar, 2020 .

An ab initio study of filled skutterudites ROs4P12 (R = Sm, Eu and Gd)

Sandeep, R. Thapa, D. P. Rai, 2015 .

A first principle study of structural, opto-electronic and thermoelectric properties of Sm filled skutterudite SmRu4Sb12

P. Mandal, A. Shankar, P. Mandal, 2021 .

Energy band structure, elastic and optical constants of the filled skutterudite CeRu4As12

Sandeep, H. Joshi, R. Thapa, 2016 .

FP-LAPW study of energy bands and optical properties of the filled skutterudite $$\hbox {CeRu}_{4}\hbox {As}_{12}$$CeRu4As12 with spin–orbit coupling

Sandeep, R. Thapa, D. P. Rai, 2016 .

Investigation of elastic and optical properties of EuFe4P12 by first principles calculation

Sandeep, R. Thapa, D. P. Rai, 2015 .

Study of 5f electron based filled skutterudite compound EuFe4Sb12, a thermoelectric (TE) material: FP-LAPW method

Sandeep, R. Thapa, D. P. Rai, 2015 .

Electronic and optical properties of CuInTe2

R. Thapa, P. Mandal, A. Shankar, 2016 .

First-principles calculations of electronic band structure and optical properties of ternary semiconductors Cd4P2Cl3 and Cd4P2Br3

P. Mandal, A. Shankar, T. Chaki, 2019 .

Ground state calculation of the electronic structure and magnetic properties of Co2VAl: a local spin density approximation with exchange correlation potential study

Sandeep, R. Thapa, D. P. Rai, 2012 .

Study of electronic and magnetic properties in 4f electron based cubic EuAlO3: a first-principles calculation

Sandeep, R. Thapa, D. P. Rai, 2015 .

Kondo effect in twisted bilayer graphene

L. Fritz, D. O. Oriekhov, A. Shankar, 2023, 2303.02492.

STUDY OF HALF-METALLIC PROPERTIES IN CO2CrSb USING GGA AND LSDA

R. Thapa, D. P. Rai, A. Shankar, 2012 .

ELECTRONIC STRUCTURE AND MAGNETIC PROPERTIES OF CO2YZ (Y = CR, V = AL, GA) TYPE HEUSLER COMPOUNDS: A FIRST PRINCIPLE STUDY

Sandeep, R. Thapa, D. P. Rai, 2012 .

Design of half-metal compensated antiferromagnets in Cu and Zn based full inverse Heusler alloys from 5-4 rule

A. Saxena, A. Shankar, M. Ram, 2020 .

Experimental and theoretical investigation of electronic and optical properties of CuAlxGa1−xTe2

A. Shankar, A. Otmani, L. Bechiri, 2022, Chemical Physics Letters.

A comparative study of electronic and thermoelectric properties of bulk , 2 D sheet and 1 D wire of Silicon : an ab-initio study

Sandeep, H. Joshi, R. Thapa, 2017 .

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

Sandeep, R. Thapa, D. P. Rai, 2017 .

A first principles study of Nd doped cubic LaAlO3 perovskite: mBJ+U study

Sandeep, R. Thapa, D. P. Rai, 2016 .

CeOs4As12: a hybridized gap semiconductor

P. K. Mandal, S. Chatterjee, R. Thapa, 2019, Indian Journal of Physics.

Kondo effect in twisted bilayer graphene

L. Fritz, D. O. Oriekhov, A. Shankar, 2023, Physical Review B.

GGA + U and mBJ + U study of the optoelectronic, magnetic and thermoelectric properties of the SmAlO3 compound with spin–orbit coupling

R. Thapa, D. P. Rai, R. Khenata, 2016 .

Modulation of optical absorption in m-Fe1−xRuxS2 and exploring stability in new m-RuS2

H. Joshi, R. Thapa, D. P. Rai, 2021, Scientific Reports.

Study of half metallicity, structural and mechanical properties in inverse Heusler alloy Mn2ZnSi(1−x)Gex and a superlattice

A. Saxena, A. Shankar, M. Ram, 2019, RSC advances.

Electronic and Piezoelectric properties of half-Heusler compounds: A first principles study

Sandeep, R. Thapa, D. P. Rai, 2016 .

Mechanical stability and origin of half-metallicity of new M2NiZ (M = Sc, Ti, and V; Z = Tl and Pb) Heusler alloys

H. Joshi, A. Shankar, N. Limbu, 2020, Journal of Applied Physics.