52 citations · 84 across the 7 of their papers we have counts for
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Quantum MASALA: Quantum MAterialS Ab initio eLectronic-structure pAckage
Shri Hari Soundararaj, Agrim Sharma, Manish Jain
We present Quantum MASALA, a compact package that implements different electronic structure methods in Python using the plane-wave basis. Within just 8100 lines of pure Python code…
Exciton fine structure in twisted transition metal dichalcogenide heterostructures
Sudipta Kundu, Tomer Amit, H. R. Krishnamurthy +2
Moiré superlattices of transition metal dichalcogenide (TMD) heterostructures give rise to rich excitonic phenomena associated with the interlayer twist angle and induced changes i…
Oxygen Vacancy-Induced Topological Hall effect in a Nonmagnetic Band Insulator
Shashank Kumar Ojha, Sanat Kumar Gogoi, Manju Mishra Patidar +7
The discovery of skyrmions has sparked tremendous interests about topologically nontrivial spin textures in recent times. The signature of noncoplanar nature of magnetic moments ca…
Native Point Defects in Mono-- and Bi--layer Phosphorene
Sudipta Kundu, Mit H. Naik, Manish Jain
We study the stability and electronic properties of intrinsic point defects, vacancy and self-interstitial, in mono- and bi-layer phosphorene. We calculate the formation energies,…
Reconstruction of moiré lattices in twisted transition metal dichalcogenide bilayers
Indrajit Maity, Prabal K. Maiti, H. R. Krishnamurthy +1
An important step in understanding the exotic electronic, vibrational, and optical properties of the moiré lattices is the inclusion of the effects of structural relaxation of the…
Phonons in Twisted Transition Metal Dichalcogenide Bilayers ("Twistnonics"): Ultra-soft Phasons, and a transition from Superlubric to Pinned Phase
Indrajit Maity, Mit H. Naik, Prabal K Maiti +2
The tunability of the interlayer coupling by twisting one layer with respect to another layer of two-dimensional materials provides a unique way to manipulate the phonons and relat…