Structural, elastic, thermodynamic and electronic properties of covellite, CuS

S Arora, K Kabra, KB Joshi, BK Sharma… - Physica B: Condensed …, 2020 - Elsevier
Covellite, the CuS, is a unique compound owing to both superconducting and metallic
behavior at different temperatures. We model and characterize the elastic, electronic and …

Acoustic shock wave-induced B1 to B2 phase transition of CdO nanoparticles: structure-property relationship and its mechanism in thermodynamic aspects

S Aswathappa, L Dai, SJD Sathiyadhas… - Acta Materialia, 2025 - Elsevier
The reversible pressure-induced B1 (NaCl)↔ B2 (CsCl)-type phase transition is one of the
classic models for understanding the general concepts of phase transition. Although several …

First-principles characterisation of structural and electronic properties of some RuO2 crystals

V Maurya, G Sharma, KB Joshi - Physica Scripta, 2021 - iopscience.iop.org
Density functional theory at the level of LDA, GGA, LDA+ U, GGA+ U and hybrid functionals
is applied to investigate structural and electronic properties of three RuO 2 crystals. The …

Electron momentum density and phase transition in SrO

R Kumar, N Munjal, G Sharma, V Vyas… - Phase …, 2012 - Taylor & Francis
In this article, we present electron momentum density distribution and phase transition in
SrO. The experimental values of momentum density have been measured using 5Ci 241Am …

Investigation of Structural and Electronic Properties of Zn3P2: Theory and Experiment

M Kaur, K Kabra, R Kumar, BK Sharma… - Journal of Electronic …, 2016 - Springer
This paper deals with the structural and electronic properties of the compound Zn 3 P 2.
Equilibrium structural properties have been calculated by fitting the energy-volume data to …

[PDF][PDF] The Pressure Induced B1-B2 Phase Transition of CdO

P Bhardwaj - Acta Physica Polonica A, 2013 - bibliotekanauki.pl
In this paper, the structural, elastic and thermodynamic properties of CdO under different
pressure range have been reported. An extended interaction potential model (including the …

Electronic structure of nano-sized ZnO: A Compton profile study

R Kumar, MC Mishra, BK Sharma, V Vyas… - Electronic Materials …, 2013 - Springer
The electronic structure of nano-sized ZnO using Compton scattering technique is reported.
The nano-crystalline ZnO of size 10.5 nm is synthesized using the chemical route and …

Electron momentum density, band structure, and structural properties of SrS

G Sharma, N Munjal, V Vyas, R Kumar… - Journal of Experimental …, 2013 - Springer
The electron momentum density, the electronic band structure, and the structural properties
of SrS are presented in this paper. The isotropic Compton profile, anisotropies in the …

Electronic structure of VO2 using Compton spectroscopy

M Vashistha, DR Phalaswal, K Kabra, R Kumar… - Materials …, 2016 - ingentaconnect.com
An 241Am source based Gamma-ray Compton spectrometer is used to measure the
experimental Compton profiles of VO2. The electron momentum density distribution is …

Analysis of the electronic structure of ZrO2 by Compton spectroscopy

FM Mahammad, SF Mahammed, R Kumar… - Journal of Experimental …, 2013 - Springer
The electronic structure of ZrO 2 is studied using the Compton scattering technique. The first-
ever Compton profile measurement on polycrystalline ZrO 2 was obtained using 59.54 keV …