activity
20142022
most citedSPARC: Accurate and efficient finite-difference formulation and parallel implementation of Density Functional Theory: Extended systems

140 citations · 314 across the 10 of their papers we have counts for

collaborators

10 papers

cond-mat.mtrl-sci2022

Order Parameter Engineering for Random Systems

G. Anand, Swarnava Ghosh, Markus Eisenbach

The chemical short-range order (CSRO) in the crystalline materials influences the properties and its effect is particularly important in the context of the multicomponent materials…

cond-mat.mtrl-sci2022★ 2 cited

Effects of the local chemical environment on vacancy diffusion in multi-principal element alloys

Mauricio Ponga, Mohamed Hendy, Okan K. Orhan +1

Multi-principal element alloys (MPEAs) are exciting systems showing remarkable properties compared to conventional materials due to their exceedingly large compositional space and…

cond-mat.mtrl-sci2021★ 16 cited

Machine-learned prediction of the electronic fields in a crystal

Ying Shi Teh, Swarnava Ghosh, Kaushik Bhattacharya

We propose an approach for exploiting machine learning to approximate electronic fields in crystalline solids subjected to deformation. Strain engineering is emerging as a widely u…

physics.comp-ph2020★ 1 cited

Spectral quadrature for the first principles study of crystal defects: Application to magnesium

Swarnava Ghosh, Kaushik Bhattacharya

We present an accurate and efficient finite-difference formulation and parallel implementation of Kohn-Sham Density (Operator) Functional Theory (DFT) for non periodic systems embe…

stat.AP2020

A Study on the Possible Effects of the Implementation of the Nordic Model in India on Crime Rates and Sexually Transmitted Diseases

Sabarinath Vinod Nair, Shreya Sharma, Swarnava Ghosh

Prostitution is one of the root causes of sex trafficking and the transmission of sexual diseases. The rules and regulations followed by the Indian government to regulate the same,…

cond-mat.mtrl-sci2020

Influence of thermomechanical loads on the energetics of precipitation in magnesium aluminum alloys

Swarnava Ghosh, Kaushik Bhattacharya

We use first principles calculations to study the influence of thermomechanical loads on the energetics of precipitation in magnesium-aluminum alloys. Using Density Functional Theo…

cond-mat.mes-hall2019★ 43 cited

Symmetry-adapted real-space density functional theory for cylindrical geometries: application to large X (X=C, Si, Ge, Sn) nanotubes

Swarnava Ghosh, Amartya S. Banerjee, Phanish Suryanarayana

We present a symmetry-adapted real-space formulation of Kohn-Sham density functional theory for cylindrical geometries and apply it to the study of large X (X=C, Si, Ge, Sn) nanotu…

physics.comp-ph2016★ 140 cited

SPARC: Accurate and efficient finite-difference formulation and parallel implementation of Density Functional Theory: Extended systems

Swarnava Ghosh, Phanish Suryanarayana

As the second component of SPARC (Simulation Package for Ab-initio Real-space Calculations), we present an accurate and efficient finite-difference formulation and parallel impleme…

physics.comp-ph2016★ 111 cited

SPARC: Accurate and efficient finite-difference formulation and parallel implementation of Density Functional Theory: Isolated clusters

Swarnava Ghosh, Phanish Suryanarayana

As the first component of SPARC (Simulation Package for Ab-initio Real-space Calculations), we present an accurate and efficient finite-difference formulation and parallel implemen…

physics.comp-ph2014★ 1 cited

Higher-order finite-difference formulation of periodic Orbital-free Density Functional Theory

Swarnava Ghosh, Phanish Suryanarayana

We present a real-space formulation and higher-order finite-difference implementation of periodic Orbital-free Density Functional Theory (OF-DFT). Specifically, utilizing a local r…