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20182022
most citedAtomic disorder and Berry phase driven anomalous Hall effect in Co2FeAl Heusler compound

42 citations · 44 across the 8 of their papers we have counts for

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physics.comp-ph2020

Population Analysis with Wannier Orbitals

Sudipta Kundu, Satadeep Bhattacharjee, Seung-Cheol Lee +1

We formulate Wannier orbital overlap population and Wannier orbital Hamilton population to describe the contribution of different orbitals to electron distribution and their intera…

physics.comp-ph2018

PASTA: Python Algorithms for Searching Transition stAtes

Sudipta Kundu, Satadeep Bhattacharjee, Seung-Cheol Lee +1

Chemical reactions are often associated with an energy barrier along the reaction pathway which hinders the spontaneity of the reaction. Changing the energy barrier along the react…