D. Gupta

发表

Investigating the magneto‐electronic, structural, mechanical, and thermodynamic properties of filled skutterudite NdRu 4 Sb 12 and EuRu 4 Sb 12 : A first‐principles perspective

S. Mir, P. Kumar, D. Gupta, 2021, International Journal of Quantum Chemistry.

Dielectric and micromechanical studies of barium titanate substituted (1-y)Pb (Zn(1/3)Nb(2/3))O(3)-yPT ferroelectric ceramics

A. Mukhopadhyay, T. Sinha, A. Himanshu, 2010 .

Electronic structure, mechanical, thermoelectric, optical, and thermodynamic properties of yttrium‐based quaternary Heusler alloys

D. Gupta, Srishti Singh, 2019, International Journal of Energy Research.

Structural and elasto-mechanical properties of ordered double perovskite Ba2LuSbO6

S. Singh, S. Mir, D. Gupta, 2019, DAE SOLID STATE PHYSICS SYMPOSIUM 2018.

Insight into electronic, mechanical and transport properties of quaternary CoVTiAl: Spin-polarized DFT + U approach

Saleem Yousuf, D. Gupta, 2017 .

DFT investigations on mechanical stability, electronic structure and magnetism in Co2TaZ (Z = Al, Ga, In) heusler alloys

D. Gupta, S. A. Khandy, 2017 .

New ferromagnetic half-metallic perovskites for spintronic applications: BaMO3 (M = Mg and Ca)

S. Mir, D. Gupta, A. Q. Seh, 2020, RSC advances.

High pressure phase-transition, elastic and thermal properties of uranium chalcogenides: A model study

D. Gupta, A. K. Baraiya, 2010 .

Investigation of half-metallic ferromagnetism and transport properties of pnictide oxides REZnAsO (RE=La, Ce, Nd, Pr, Gd, Eu, Sm, Dy) for spintronics

Saadi Berri, N. Bouarissa, D. Gupta, 2022, Computational Condensed Matter.

Forecasting electronic-band structure and magnetism in complex double perovskite Ba2CdReO6

S. Mir, R. A. Mir, S. Singh, 2020 .

Study of semiconducting nanomaterials under pressure

P. Rana, D. Gupta, P. Rana, 2012, Journal of Molecular Modeling.

Scrutinizing the Stability and Exploring the Dependence of Thermoelectric Properties on Band Structure of 3d Metal-Based Double Perovskites: An ab-initio Analysis

S. Mir, D. Gupta, 2021 .

High pressure stability analysis and chemical bonding of Ti1-xZrxN alloy: A first principle study

D. Gupta, M. Chauhan, 2016 .

Alloying effects on structural and thermal behavior of Ti1-xZrxC: A first principles study

D. Gupta, M. Chauhan, 2016 .

Structural phase transition, elastic and electronic properties of TmSb and YbSb: A LSDA + U study under pressure

Sanjay Singh, D. Gupta, 2012 .

DySb under high pressures: A full-potential study

D. Gupta, Subhra Kulshrestha, 2011 .

Investigation of spin polarized band structure, magnetism, and mechanical properties of new gapless Zr2NbX (X= Al, Ga, In) Heusler alloys

Saleem Yousuf, D. Gupta, 2018, Journal of Alloys and Compounds.

Impedance spectroscopy of perovskite barium substituted lead zinc niobate ceramics

T. Sinha, A. Himanshu, D. Gupta, 2010 .

Exploration of uranium double perovskites Ba2MUO6 (M = Co, Ni) for magnetism, spintronic and thermoelectric applications

S. Mir, D. Gupta, 2020 .

First principle study of mechanical stability, magneto-electronic and thermodynamic properties of double perovskites: A2MgWO6 (A = Ca, Sr)

S. Mir, Saleem Yousuf, D. Gupta, 2019, Materials Science and Engineering: B.

Study of Electronic, Magnetic, and Thermoelectric Properties of 24 Valence-Electron Fe2TiSn Heusler Compound Using Modified Becke-Johnson Scheme

D. Gupta, Tahir Mohiuddin Bhat, Tahir Bhat, 2018 .

DFT analogue of prospecting the spin-polarised properties of layered perovskites Ba2ErNbO6 and Ba2TmNbO6 influenced by electronic structure

D. Gupta, S. A. Khandy, 2022, Scientific Reports.

Structural properties of silver iodide and copper iodide

D. Gupta, N. Gaur, Sadhan Singh, 2008 .

LEAD-CHALCOGENIDES UNDER PRESSURE: AB-INITIO STUDY

D. Gupta, Idris M. M. Hamid, 2013 .

Exploration of highly correlated Co‐based quaternary Heusler alloys for spintronics and thermoelectric applications

D. Gupta, A. Q. Seh, 2019, International Journal of Energy Research.

A DFT Study on Structural, Electronic Mechanical and Thermodynamic Properties of 5f-Electron System BaAmO3

S. Dar, D. Gupta, V. Srivastava, 2017, Journal of Superconductivity and Novel Magnetism.

Magneto-electronic, mechanical, thermoelectric and thermodynamic properties of ductile perovskite Ba2SmNbO6

D. Gupta, S. A. Khandy, 2020 .

Unravelling the magnetism, high spin polarization and thermoelectric efficiency of ZrFeSi half-Heusler

Saleem Yousuf, D. Gupta, 2018 .

Evaluation of mechanical and transport properties of Zr2CoSi Heusler alloy

Saleem Yousuf, D. Gupta, Tahir Mohiuddin Bhat, 2017 .

High-Pressure and Temperature Dependence of Electronic, Magnetic, Elastic, Thermodynamic, and Transport Properties of Full-Heusler Alloys Co2YIn (Y = Nb, Zr)

Sukriti Ghosh, D. Gupta, 2017, Journal of Superconductivity and Novel Magnetism.

Electronic structure, optical and thermoelectric properties of CaMgSi1−xCx (x = 0, 0.5): an ab-initio study

S. Rubab, Muhammad Tanveer, W. Khan, 2018, Materials Research Express.

Structural and elastic properties of copper iodide

D. Gupta, N. Gaur, D. Baghmar, 2010 .

Thermo-elastic and structural properties of thorium chalcogenides: A high pressure study

Kailash Singh, D. Gupta, K. Singh, 2010 .

Phase transition and specific heat anomaly in B⇄Z and other conformational transitions in poly(dG-dC)

P. Tandon, D. Gupta, V. D. Gupta, 1992 .

Thermodynamic Anomaly and Transitions in Various States of Poly (dG-dC)

P. Tandon, D. Gupta, V. D. Gupta, 1992 .

Structural, Magneto‐electronic, Mechanical, and Thermophysical Properties of Double Perovskite Ba2ZnReO6

Saleem Yousuf, D. Gupta, S. A. Khandy, 2019, physica status solidi (b).

Investigation of structural, magneto‐electronic, and thermoelectric response of ductile SnAlO3 from high‐throughput DFT calculations

D. Gupta, S. A. Khandy, 2017 .

Structural, elastic and thermo-electronic properties of paramagnetic perovskite PbTaO3

D. Gupta, S. A. Khandy, 2016 .

Electronic, elastic and thermoelectric performance in n-type Sr-filled brittle skutterudite

D. Gupta, Tahir Mohiuddin Bhat, Muskan Nabi, 2020 .

Simplistic Theoretical Model for Optoelectronic Properties of Compound Semiconductors

A. Verma, D. Gupta, R. Tiwari, 2014 .

Scrutinized the inherent spin half-metallicity and thermoelectric response of f-electron-based RbMO3 (M = Np, Pu) perovskites: a computational assessment

D. Gupta, Mudasir Younis Sofi, 2022, Scientific Reports.

Systematic investigation of the magneto-electronic structure and optical properties of new halide double perovskites Cs2NaMCl6 (M = Mn, Co and Ni) by spin polarized calculations

S. Mir, D. Gupta, 2020, RSC advances.

Study of the magneto-electronic, optical, thermal and thermoelectric applications of double perovskites Ba2MTaO6 (M = Er, Tm)

D. Gupta, Muskan Nabi, 2019, RSC advances.

DFT investigations on the electronic structure, magnetism, thermodynamic and elastic properties of newly predicted cobalt based antiperovskites: Co3XN (X = Pd, Pt & Rh)

S. Rubab, Kulwinder Kaur, R. Khenata, 2020, Results in Physics.

Insight into various properties of rare‐earth–based inverse perovskites Gd3AlX (X = B, N)

D. Gupta, Muskan Nabi, 2019, International Journal of Energy Research.

High pressure phase transition and elastic behaviour of lanthanum monochalcogenides

D. Gupta, G. S. Raypuria, 2011 .

Investigation of magneto-electronic properties of double perovskite Ba2ZnReO6

S. Singh, S. Mir, Saleem Yousuf, 2019, DAE SOLID STATE PHYSICS SYMPOSIUM 2018.

Understanding the origin of half‐metallicity and thermophysical properties of ductile La2CuMnO6 double perovskite

S. Mir, D. Gupta, 2019, International Journal of Energy Research.

Insight view of double perovskites Ba2XNbO6 (X = Ho,Yb) for spintronics and thermoelectric applications

D. Gupta, S. A. Khandy, 2021, International Journal of Energy Research.

Exploring the magneto-electronic, mechanical, optical and thermoelectric performance of paramagnetic Ba2TmSbO6

D. Gupta, Muskan Nabi, 2019, Materials Research Express.

High-pressure phase transition and thermoelastic properties of europium chalcogenides

Kailash Singh, D. Gupta, K. Singh, 2012, Journal of Molecular Modeling.

Magnetic, Electronic, and Mechanical Properties of Strongly Correlated Samarium Mono-chalcogenides under High Pressure

D. Gupta, Subhra Kulshrestha, 2010 .

Pressure induced magnetic, electronic and mechanical properties of SmX (X = Se, Te)

D. Gupta, Subhra Kulshrestha, 2009, Journal of physics. Condensed matter : an Institute of Physics journal.

Phase transition properties of SmTe under pressure

D. Gupta, Subhra Kulshrestha, 2009 .

Structural, elastic, thermodynamic and thermoelectric properties of Fe2TiSn Heusler alloy: High pressure study

D. Gupta, Tahir Mohiuddin Bhat, Muskan Nabi, 2019, Results in Physics.

High-Pressure and Temperature Dependence of Electronic, Magnetic, Elastic, Thermodynamic, and Transport Properties of Full-Heusler Alloys Co2YIn (Y = Nb, Zr)

Sukriti Ghosh, D. Gupta, 2018 .

Magneto-electronic and thermoelectric properties of some Fe-based Heusler alloys

D. Gupta, Tahir Mohiuddin Bhat, Idris Hamid Bhat, 2018 .

Pressure- and Temperature-Dependent Study of Heusler Alloys Cu2MGa (M = Cr and V)

Sukriti Ghosh, D. Gupta, 2017, Journal of Electronic Materials.

Electronic, magnetic, elastic and thermodynamic properties of Cu2MnGa

Sukriti Ghosh, D. Gupta, 2016 .

Investigation of electronic structure, magnetic and transport properties of half-metallic Mn2CuSi and Mn2ZnSi Heusler alloys

Saleem Yousuf, D. Gupta, Tahir Mohiuddin Bhat, 2015 .

Magnetic, electronic, high-spin polarization and half-metallic properties of Ru2VGe and Ru2VSb Heusler alloys: An FP-LAPW study

D. Gupta, Idris Hamid Bhat, 2015 .

Effect of pressure on electronic, magnetic, thermodynamic, and thermoelectric properties of tantalum‐based double perovskites Ba2MTaO6 (M = Mn, Cr)

D. Gupta, Tahir Mohiuddin Bhat, Muskan Nabi, 2019, International Journal of Energy Research.

Structural, electronic, mechanical and thermo-physical properties of TMN (TM = Ti, Zr and Hf) under high pressures: A first-principle study

D. Gupta, M. Chauhan, 2014 .

Electronic structure, magnetism and thermoelectric properties of double perovskite Sr 2 HoNbO 6

D. Gupta, S. A. Khandy, 2018, Journal of Magnetism and Magnetic Materials.

Analysis of mechanical, thermodynamic, and thermoelectric properties of ferromagnetic SrFe4As12 skutterudite

D. Gupta, Tahir Mohiuddin Bhat, 2018, Journal of Solid State Chemistry.

Full Heusler alloys (Co2TaSi and Co2TaGe) as potential spintronic materials with tunable band profiles

D. Gupta, Ishtihadah Islam, S. A. Khandy, 2019, Journal of Solid State Chemistry.

Structural Stability and Chemical Bonding of TiN: Ab Initio Study

D. Gupta, M. Chauhan, Idris Hamid Bhat, 2014 .

Magneto-Electronic, Thermodynamic, and Thermoelectric Properties of 5f-Electron System BaBkO3

D. Gupta, Tahir Mohiuddin Bhat, Muskan Nabi, 2018, Journal of Superconductivity and Novel Magnetism.

Robustness in ferromagnetic phase stability, half‐metallic behavior and transport properties of cobalt‐basedfull‐Heuslerscompounds: A first principles approach

D. Gupta, S. Sofi, 2020 .

PHASE TRANSITION OF PRASEODYMIUM MONO-PNICTIDES UNDER HIGH PRESSURE

D. Gupta, G. S. Raypuria, 2013 .

Unravelling the magnetism, thermophysical, mechanical and thermoelectric properties of Co-based heuslers: An ab-initio prospective

T. Alshahrani, E. F. El-Shamy, D. Gupta, 2022, Physica B: Condensed Matter.

High temperature and pressure study on structural and thermophysical properties of Co2XAl (X = Zr, Nb, Hf) Heusler materials by density functional theory calculations

D. Gupta, S. Sofi, 2021 .

Current research and future prospective of cobalt‐based Heusler alloys as thermoelectric materials: A density functional approach

D. Gupta, S. Sofi, 2020, International Journal of Energy Research.

Systematic study of ferromagnetic phase stability of Co-based Heusler materials with high figure of merit: Hunt for spintronics and thermoelectric applicability

D. Gupta, S. Sofi, 2020 .

Thermoelectric response of ZrNiSn and ZrNiPb Half-Heuslers: Applicability of semi-classical Boltzmann transport theory

Saleem Yousuf, D. Gupta, 2019, Results in Physics.

Investigation of structural, elastic, thermophysical, magneto‐electronic, and transport properties of newly tailored Mn‐based Heuslers: A density functional theory study

D. Gupta, S. Sofi, 2020 .

Investigation of high pressure and temperature study of thermo-physical properties in semiconducting Fe2ZrSi Heusler

D. Gupta, S. Sofi, 2020 .

Chemical Stability and Thermodynamics of New Zr₂-based Heusler Alloys

Saleem Yousuf, D. Gupta, 2018, Materials Engineering Research.

Effect of High Pressure and Temperature on Structural, Thermodynamic and Thermoelectric Properties of Quaternary CoFeCrAl Alloy

D. Gupta, Tahir Mohiuddin Bhat, 2018, Journal of Electronic Materials.

Analysis of magneto-electronic, thermodynamic and thermoelectric properties of ferromagnetic CoFeCrAl alloy

D. Gupta, Tahir Mohiuddin Bhat, 2017 .

A first-principles study of RuMn2Si: Magnetic, electronic and mechanical properties

D. Gupta, Idris Hamid Bhat, 2013 .

Comprehensive DFT investigation of transition-metal-based new quaternary Heusler alloys CoNbMnZ (Z = Ge, Sn): compatible for spin-dependent and thermoelectric applications

D. Gupta, A. Q. Seh, 2020, RSC advances.

Investigation of high spin-polarization, magnetic, electronic and half-metallic properties in RuMn2Ge and RuMn2Sb Heusler alloys

D. Gupta, Idris Hamid Bhat, 2015 .

Lanthanum based quaternary Heusler alloys LaCoCrX (X = Al, Ga): Hunt for half-metallicity and high thermoelectric efficiency

D. Gupta, Srishti Singh, 2019, Results in Physics.

Quaternary Heusler alloy CoZrMnAs competent candidate for spintronics and thermoelectric technologies

D. Gupta, A. Q. Seh, 2022, Energy Storage.

Electronic, ductile, phase transition and mechanical properties of Lu-monopnictides under high pressures

D. Gupta, Idris Hamid Bhat, 2013, Journal of Molecular Modeling.

Electronic Structure, Optical and Transport Properties of Double Perovskite La2NbMnO6: A Theoretical Understanding from DFT Calculations

S. Rubab, Abduazimkhodjaev Aziz, R. Khenata, 2018, Journal of Electronic Materials.

Scrutinizing the stability and exploring the dependence of thermoelectric properties on band structure of 3d-3d metal-based double perovskites Ba2FeNiO6 and Ba2CoNiO6

S. Mir, D. Gupta, 2021, Scientific Reports.

Systematic understanding of f‐electron–based semiconducting actinide perovskites Ba2MgMO6 (M = U, Np) from DFT ab initio calculations

D. Gupta, S. A. Khandy, 2020, International Journal of Energy Research.

Inspecting the Thermoelectric Response and Mechanical Stability of Novel Cobalt‐Based Heusler Alloys: A DFT Insight

T. Alshahrani, D. Gupta, M. Morsi, 2022, physica status solidi (b).

Pursuit of thermoelectric properties in L21 structured Co2PAl (P = Ru, Rh) ductile ferromagnetic materials: A first principles prospective

D. Gupta, S. Sofi, 2021 .

High Pressure-Temperature study on thermodynamics, half-metallicity, transport, elastic and structural properties of Co-based Heusler alloys: A first-principles study

D. Gupta, S. Sofi, 2020 .

Predicting the electronic structure, magnetism, and transport properties of new Co‐based Heusler alloys

D. Gupta, Ishtihadah Islam, S. A. Khandy, 2018, International Journal of Energy Research.

Study of ferromagnetism, spin-polarization, thermoelectrics and thermodynamics of layered perovskite Ba2FeMnO6 under pressure and temperature

D. Gupta, S. A. Khandy, 2019 .

Effect of 3d transition metal doping (Co, Ni and Cu) on structural, optical, morphological and dielectric properties of sol–gel assisted auto-combusted Mg0.95Mn0.05O nanoparticles

A. K. Hafiz, A. Siddiqui, D. Gupta, 2018, Journal of Materials Science: Materials in Electronics.

Lattice dynamics, mechanical stability and electronic structure of Fe-based Heusler semiconductors

R. Khenata, D. Gupta, Ishtihadah Islam, 2019, Scientific Reports.

A DFT Study on Structural, Electronic Mechanical and Thermodynamic Properties of 5f-Electron System BaAmO3

S. Dar, D. Gupta, V. Srivastava, 2017 .

Ternary germanide Li2ZnGe: A new candidate for high temperature thermoelectrics

Saleem Yousuf, D. Gupta, 2018 .

Quaternary Heusler alloys a future perspective for revolutionizing conventional semiconductor technology

D. Gupta, A. Q. Seh, 2021 .

Potential lead-free small band gap halide double perovskites Cs2CuMCl6 (M = Sb, Bi) for green technology

D. Gupta, Muskan Nabi, 2021, Scientific Reports.

First-principles study of high spin-polarization and thermoelectric efficiency of ferromagnetic CoFeCrAs quaternary Heusler alloy

D. Gupta, Tahir Mohiuddin Bhat, 2018 .

Chemical Potential Evaluation of Thermoelectric and Mechanical Properties of Zr2CoZ (Z = Si, Ge) Heusler Alloys

Saleem Yousuf, D. Gupta, 2018, Journal of Electronic Materials.

Insight into mechanical properties and thermoelectric efficiency of Zr2CoZ (Z = Si, Ge) Heusler alloys

Saleem Yousuf, D. Gupta, 2017 .

Robust thermoelectric performance and high spin polarisation in CoMnTiAl and FeMnTiAl compounds

D. Gupta, Tahir Mohiuddin Bhat, 2016 .

Transport, Structural and Mechanical Properties of Quaternary FeVTiAl Alloy

D. Gupta, Tahir Mohiuddin Bhat, 2016, Journal of Electronic Materials.

Lattice dynamics, mechanical stability and electronic structure of Fe-based Heusler semiconductors

R. Khenata, D. Gupta, Ishtihadah Islam, 2019, Scientific Reports.

Inter atomic force constants of binary and ternary tetrahedral semiconductors

A. Verma, V. Saraswat, D. Gupta, 2016 .

DFT understandings of structural properties, mechanical stability and thermodynamic properties of BaCfO3 perovskite

S. Rubab, R. Khenata, D. Gupta, 2018, Materials Research Express.

Electronic structure, mechanical and thermodynamic properties of BaPaO3 under pressure

D. Gupta, Ishtihadah Islam, S. A. Khandy, 2018, Journal of Molecular Modeling.

Analysis of Cage Structured Halide Double Perovskites Cs2NaMCl6 (M = Ti, V) by Spin Polarized Calculations

D. Gupta, S. Mir, 2021 .

Electronic structure, magnetism and thermoelectricity in layered perovskites: Sr 2 SnMnO 6 and Sr 2 SnFeO 6

D. Gupta, S. A. Khandy, 2017 .

Full-potential study of Fe2NiZ (Z = Al, Si, Ga, Ge)

D. Gupta, Idris Hamid Bhat, 2014 .

Investigation of the transport, structural and mechanical properties of half-metallic REMnO3 (RE = Ce and Pr) ferromagnets

D. Gupta, S. A. Khandy, 2016 .

Investigation of pressure induced phase transition and thermoelectrics of semiconducting Fe2ZrSi

S. Mir, R. A. Mir, S. Singh, 2020 .

A case study of Fe2TaZ (Z = Al, Ga, In) Heusler alloys: hunt for half-metallic behavior and thermoelectricity

S. Rubab, Shabir Ahmad, D. Gupta, 2018, RSC advances.

Structural, elastic and magneto-electronic properties of half-metallic BaNpO3 perovskite

D. Gupta, S. A. Khandy, 2017 .

Magneto-electronic, thermal, and thermoelectric properties of some Co-based quaternary alloys

D. Gupta, Tahir Mohiuddin Bhat, 2018 .

Probing the structural, mechanical, phonon, thermal, and transport properties of magnetic halide perovskites XTiBr3 (X = Rb, Cs) through ab-initio results

D. Gupta, S. A. Khandy, Vishal Shivhare, 2023, Scientific reports.

Tantalum half-Heusler alloys RbTaSi and RbTaGe: potential candidates for desirable thermoelectric and spintronic applications

S. Mir, D. Gupta, N. A. Ganie, 2023, RSC advances.

Insight View of Magneto-Electronic, Mechanical and Thermophysical Properties of Novel Filled Skutterudites LiFe4X12 (X = As, Sb) via ab-initio Calculations

D. Gupta, P. Kumar, 2021 .

Structural and mechanical stabilities, electronic, magnetic and thermophysical properties of double perovskite Ba2LaNbO6: Probed by DFT computation

S. Mir, D. Gupta, 2021, International Journal of Energy Research.

Magneto-electronic, thermoelectric, thermodynamic and optical properties of rare earth YCoTiX (X = Al, Ga, Si, Ge) alloys

D. Gupta, Srishti Singh, 2019, Journal of Alloys and Compounds.

Investigation of Electronic, Magnetic, Thermodynamic, and Thermoelectric Properties of Half-Metallic XLiSn (X = Ce, Nd) Alloys

D. Gupta, Srishti Singh, 2018, Journal of Superconductivity and Novel Magnetism.

Temperature and pressure dependent structural and thermo-physical properties of quaternary CoVTiAl alloy

Saleem Yousuf, D. Gupta, 2017 .

First-principal study of full Heusler alloys Co2VZ (Z = As, In)

Sukriti Ghosh, D. Gupta, 2017 .

Structural and dielectric behaviour of barium substituted lead zinc niobate ceramics at low temperature

Alo Dutta, T. Sinha, A. Himanshu, 2009 .

Pressure-induced phase transitions and electronic structure of GaAs

D. Gupta, Subhra Kulshrestha, 2008 .

Pressure variation of electronic and magnetic properties of LaCoCrAl quaternary Heusler alloy

S. Mir, Saleem Yousuf, D. Gupta, 2019, DAE SOLID STATE PHYSICS SYMPOSIUM 2018.

Silicon-Germanium Heterojunction Bipolar Transistor DC and AC Analysis Operating under Cryogenic Temperature

K. Nayak, D. Gupta, 2022, Electronics.

Analysing cation-modified magnetic perovskites A2SnFeO6 (A = Ca, Ba): a DFT study

D. Gupta, S. A. Khandy, 2021, RSC advances.

Investigation of electronic, magnetic and thermoelectric properties of Zr2NiZ (Z = Al,Ga) ferromagnets

Saleem Yousuf, D. Gupta, 2017 .

High temperature and pressure dependent structural and thermophysical properties of Co2VN (N = Sn, Sb) ferromagnetic materials

D. Gupta, S. Sofi, 2020, Materials Research Express.

Effect of High Pressure and Temperature on Magneto-Electronic, Thermodynamic, and Transport Properties of Antiferromagnetic HoPdX (X = As, Ge) Alloys

D. Gupta, Tahir Mohiuddin Bhat, Srishti Singh, 2018, Journal of Superconductivity and Novel Magnetism.

Effect of High Pressure and Temperature on Magneto-Electronic, Thermodynamic, and Transport Properties of Antiferromagnetic HoPdX (X = As, Ge) Alloys

D. Gupta, Tahir Mohiuddin Bhat, Srishti Singh, 2018, Journal of Superconductivity and Novel Magnetism.

Thermal, electronic and ductile properties of lead-chalcogenides under pressure

D. Gupta, Idris Hamid Bhat, 2013, Journal of Molecular Modeling.

Structural, Mechanical and Dynamical Stabilities of K2NaMCl6 (M: Cr, Fe) Halide Perovskites along with Electronic and Thermal Properties

D. Gupta, Danish Abdullah, 2023, Journal of Magnetism and Magnetic Materials.

Understanding the origin of semiconducting ferromagnetic character along with the high figure of merit in Cs2NaMCl6 (M = Cr, Fe) double perovskites

S. Mir, D. Gupta, 2021 .

Analysis of electronic, thermal, and thermoelectric properties of the half-Heusler CrTiSi material using density functional theory

D. Gupta, Tahir Mohiuddin Bhat, 2018, Journal of Physics and Chemistry of Solids.

Thermoelectric and mechanical properties of gapless Zr2MnAl compound

Saleem Yousuf, D. Gupta, 2016, Indian Journal of Physics.

Synthesis and characterisation of some new cyanonitrosyl chromium(l) complexes with phenetidines and anisidines

D. Gupta, M. Maurya, R. Maurya, 1986 .

Effect of on-site Coulomb interaction on electronic and transport properties of 100% spin polarized CoMnVAs

Dinesh C. Gupta, D. Gupta, Tahir Mohiuddin Bhat, 2017 .

Transport properties of spin polarised quaternary CoMnVAs alloy

Saleem Yousuf, D. Gupta, S. A. Khandy, 2017 .

Analysis of Structural, Electro-magnetic, Mechanical, Thermodynamic, and Thermoelectric Properties of Potassium based perovskites

D. Gupta, S. Gautam, 2023, Journal of Magnetism and Magnetic Materials.

Robustness in spin polarization and thermoelectricity in newly tailored Mn2-based Heusler alloys

Saleem Yousuf, D. Gupta, 2018 .

Prediction of robustness of electronic, magnetic and thermoelectric properties under pressure and temperature variation in Co2MnAs alloy

Saleem Yousuf, D. Gupta, S. Sofi, 2019, Computational Condensed Matter.

Insight into half-metallicity, spin-polarization and mechanical properties of L21 structured MnY2Z (Z= Al, Si, Ga, Ge, Sn, Sb) Heusler alloys

Saleem Yousuf, D. Gupta, 2018 .

Phase stability, ductility, electronic, elastic and thermo-physical properties of TMNs (TM = V, Nb and Ta): An ab initio high pressure study

D. Gupta, M. Chauhan, 2014 .

Electronic, mechanical, phase transition and thermo-physical properties of TiC, ZrC and HfC: High pressure computational study

D. Gupta, M. Chauhan, 2013 .

Structural and magnetic stability of Fe2NiSi

D. Gupta, M. Chauhan, Idris Hamid Bhat, 2014 .

Intrinsic magnetism and thermoelectric applicability of novel halide perovskites Cs2GeMnX6 (X = Cl, Br): Route towards spintronics and energy harvesting technologies

D. Gupta, S. A. Khandy, 2021 .

Small‐band gap halide double perovskite for optoelectronic properties

D. Gupta, Muskan Nabi, 2020, International Journal of Energy Research.

Temperature and pressure dependent electronic, mechanical and thermal properties of f-electron based ferromagnetic barium neptunate

S. Dar, D. Gupta, Ishtihadah Islam, 2017 .

Understanding Ferromagnetic Phase Stability, Electronic and Transport Properties of BaPaO3 and BaNpO3 from Ab-Initio Calculations

D. Gupta, S. A. Khandy, 2017, Journal of Electronic Materials.

New isostructural halide double perovskites Cs2GeNiX6 (X= Cl, Br) for semiconductor spintronics and thermoelectric advancements

D. Gupta, S. A. Khandy, 2021 .

Exploration of electronic structure, mechanical stability, magnetism, and thermophysical properties of L21 structured Co2XSb (X = Sc and Ti) ferromagnets

D. Gupta, S. Sofi, 2019, International Journal of Energy Research.

Investigation of structural, electro-magnetic properties of 5f-electron system Cs2NaBkCl6

S. Mir, R. A. Mir, S. Singh, 2020 .

First-Principles Calculations to Investigate Structural, Electronic, Phonon, Magnetic and Thermal Properties of Stable Halide Perovskite Semiconductors Cs2GeMnI6 and Cs2GeNiI6

T. Alshahrani, D. Gupta, S. A. Khandy, 2023, Journal of Alloys and Compounds.

Exploring the half-metallic ferromagnetism, dynamical and mechanical stability, optoelectronic and thermoelectric properties of K2NaMI6 (M = Mn, Co, Ni) for spintronic applications

D. Gupta, Danish Abdullah, 2023, Scientific reports.

Electronic, mechanical, phase transition, and thermo-physical properties of TMC (TM = V, Nb, and Ta): high pressure ab initio study

D. Gupta, M. Chauhan, 2015 .

Exploring the structural, Mechanical, electronic, optical, and thermoelectric properties of Cesium-based double perovskite Cs2GeSnX6 (X = Cl, Br, I) compounds: A DFT study

D. Gupta, Danish Abdullah, 2023, Materials Science in Semiconductor Processing.

Effect of variation of metal and non‐metal elements on various properties of rare‐earth‐based inverse perovskites Gd 3 XY (X = Ga, In and Y = B, N)

D. Gupta, Muskan Nabi, 2020 .

Effect of high pressure on polymorphic phase transition and electronic structure of XAs (X=Al, Ga, In)

D. Gupta, Subhra Kulshrestha, 2009 .