179 citations
- Homi Bhabha National InstituteIN60 papers
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- Bhabha Atomic Research CentreIN13 papers
- Institute of Atomic and Molecular Sciences, Academia SinicaTW10 papers
- Institute of Mathematical SciencesIN8 papers
- Institute of Physics, BhubaneshwarIN7 papers
- Saha Institute of Nuclear PhysicsIN7 papers
- UGC DAE Consortium for Scientific ResearchIN7 papers
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13 papers · 1 filter
Strain Engineering of 2D-C3N5 Monolayer and its Application in Overall Water-Splitting: A Hybrid Density Functional Study
Shakti Singh, P. Anees, Sharat Chandra +1
The recent experimental synthesis of 2D graphitic C3N5 has attracted lot of interests in its electronic and optical properties and its comparison with other graphitic C3N4 and C3N3…
Monte Carlo calculation of organ and effective dose rates from ground contaminated by Am 241: Results of an international intercomparison exercise
J Eakins, C Huet, H Brkić +12
An intercomparison exercise is described that examines Monte Carlo modelling of anthropomorphic voxel phantoms in an idealized ground-contamination photon exposure scenario. Thirte…
Atomistic simulations of twin boundary effect on the crack growth behaviour in BCC Fe
G. Sainath, A. Nagesha
In this paper, the effect of twin boundaries on the crack growth behaviour of single crystal BCC Fe has been investigated using molecular dynamics simulations. The growth of an ato…
Role of twin boundary position on the yield strength of Cu nanopillars
G. Sainath, P. Rohith, A. Nagesha
It is well known that the twin boundary (TB) spacing plays an important role in controlling the strength of twinned metallic nanopillars. One of the reasons attributed to this stre…
Half-Metallicity in Smallest Cage-like Cluster of CdTe with Doping of Transition Metal Atoms
Kashinath Tukaram Chavan, Sharat Chandra, Anjali Kshirsagar
We report first principles theory based electronic structure studies of a semiconducting stoichiometric cage-like Cd9Te9 cluster. Substantial changes are observed in the electronic…
Evolution of magnetic and transport properties in Cu doped pyrochlore iridate Eu2(Ir1-xCux)2O7
Sampad Mondal, M. Modak, B. Maji +5
We have investigated the effect of Cu substitution in Eu2(Ir1-xCux)2O7 with the help of magnetic and transport property measurements. XPS measurement reveals that each Cu2+ convert…