Ramesh C. Sharma

Raebareli, UP 229001, India

Last Updated: 09/26/2026

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Found 31 publications

Energy harvesting potential of LiHfIrZ (Z = Si, Ge) quaternary Heusler alloys: a first-principles computational study.

Energy harvesting potential of LiHfIrZ (Z = Si, Ge) quaternary Heusler alloys: a first-principles computational study.

Journal: Scientific reports
Published: March 09, 2026

LiMPtTl (M = Ti, Zr) Heusler alloys for high-performance energy harvesting: a DFT study.

LiMPtTl (M = Ti, Zr) Heusler alloys for high-performance energy harvesting: a DFT study.

Journal: Scientific reports
Published: February 16, 2026

DFT-driven insights into (Sr/Ba)2GaBiO6 double perovskites for next-generation optoelectronic and thermoelectric technologies.

DFT-driven insights into (Sr/Ba)2GaBiO6 double perovskites for next-generation optoelectronic and thermoelectric technologies.

Journal: Scientific reports
Published: December 16, 2025

Effect of spin polarization on multifunctional physical properties of the quaternary Heusler alloys CrZCoSn (Z = Zr, Hf) for energy technologies: A comprehensive DFT study.

Effect of spin polarization on multifunctional physical properties of the quaternary Heusler alloys CrZCoSn (Z = Zr, Hf) for energy technologies: A comprehensive DFT study.

Journal: Scientific reports
Published: October 29, 2025

First-principles study of CO2 activation on pristine and defected XO2 (X= Pd, Pt) monolayers.

First-principles study of CO2 activation on pristine and defected XO2 (X= Pd, Pt) monolayers.

Journal: Journal of molecular graphics & modelling
Published: October 17, 2025

First-principles identification of PtTiGe and PtTiPb as high-efficiency thermoelectric half-Heuslers.

First-principles identification of PtTiGe and PtTiPb as high-efficiency thermoelectric half-Heuslers.

Journal: Scientific reports
Published: September 13, 2025

Exploring the mechanical, vibrational optoelectronic, and thermoelectric properties of novel half-Heusler FeTaX (X = P, As): a first-principles study.

Exploring the mechanical, vibrational optoelectronic, and thermoelectric properties of novel half-Heusler FeTaX (X = P, As): a first-principles study.

Journal: RSC advances
Published: December 06, 2023

Comprehensive first principles to investigate optoelectronic and transport phenomenon of lead-free double perovskites Ba2AsBO6 (B[bond, double bond]Nb, Ta) compounds.

Comprehensive first principles to investigate optoelectronic and transport phenomenon of lead-free double perovskites Ba2AsBO6 (B[bond, double bond]Nb, Ta) compounds.

Journal: Heliyon
Published: November 23, 2023

Ab initio investigations of the structure-stability, mechanical, electronic, thermodynamic and optical properties of Ti2FeAs Heusler alloy.

Ab initio investigations of the structure-stability, mechanical, electronic, thermodynamic and optical properties of Ti2FeAs Heusler alloy.

Journal: RSC advances
Published: October 24, 2023

Comprehensive analysis of novel cubic HgCrO3 perovskite: a first principles, structural, thermodynamic, and magnetic properties study for spintronic applications.

Comprehensive analysis of novel cubic HgCrO3 perovskite: a first principles, structural, thermodynamic, and magnetic properties study for spintronic applications.

Journal: RSC advances
Published: September 19, 2023

Physical, optoelectronic and thermoelectric characteristics of double perovskite (Sr2ScBiO6) for green energy technology using ab initio computations.

Physical, optoelectronic and thermoelectric characteristics of double perovskite (Sr2ScBiO6) for green energy technology using ab initio computations.

Journal: RSC advances
Published: August 09, 2023

First principles investigation of halide based Rb2NaGaZ6 (Z = Br, I) double perovskites for energy harvesting applications.

First principles investigation of halide based Rb2NaGaZ6 (Z = Br, I) double perovskites for energy harvesting applications.

Journal: RSC advances
Published: July 26, 2023
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Last Updated: 09/26/2026