3 papers
cond-mat.mtrl-sci2023
Unveiling Defect Physics in Gapped Metals: A Theoretical Investigation into Defect Formation and Electronic Structure Interplay
Harshan Reddy Gopidi, Lovelesh Vashist, Oleksandr I. Malyi
In materials science, point defects play a crucial role in materials properties. This is particularly well known for the wide band gap insulators where the defect formation/compens…
cond-mat.mtrl-sci2023
Physics of band-filling correction in defect calculations of solid-state materials
Harshan Reddy Gopidi, Lovelesh Vashist, Oleksandr I. Malyi
In solid-state physics/chemistry, a precise understanding of defect formation and its impact on the electronic properties of wide-bandgap insulators is a cornerstone of modern semi…
cond-mat.mtrl-sci2023
Noble gas functional defect with unusual relaxation pattern in solids
Lovelesh, Harshan Reddy Gopidi, Muhammad Rizwan Khan +1
The conventional understanding has always been that noble gases are chemically inert and do not affect materials properties. This belief has led to their use as a standard referenc…