V. Gavini

List of research outcomes

This list is not complete and representing at the moment only items from zbMATH Open and arXiv. We are working on additional sources - please check back here soon!

Publication	Date of Publication	Type
TTDFT: a GPU accelerated Tucker tensor DFT code for large-scale Kohn-Sham DFT calculations Computer Physics Communications	2023-06-05	Paper
DFT-FE 1.0: a massively parallel hybrid CPU-GPU density functional theory code using finite-element discretization Computer Physics Communications	2023-05-04	Paper
DFT-FE - a massively parallel adaptive finite-element code for large-scale density functional theory calculations Computer Physics Communications	2023-04-25	Paper
Treecode-accelerated Green iteration for Kohn-Sham density functional theory Journal of Computational Physics	2022-04-11	Paper
Accurate approximations of density functional theory for large systems with applications to defects in crystalline solids	2021-12-11	Paper
NURBS-based non-periodic finite element framework for Kohn-Sham density functional theory calculations Journal of Computational Physics	2020-07-07	Paper
Electronic Structure Calculations at Macroscopic Scales using Orbital-Free DFT Recent Progress in Orbital-free Density Functional Theory	2017-11-17	Paper
Higher-order adaptive finite-element methods for Kohn-Sham density functional theory Journal of Computational Physics	2016-12-05	Paper
Higher-order adaptive finite-element methods for orbital-free density functional theory Journal of Computational Physics	2014-04-23	Paper
A field theoretical approach to the quasi-continuum method Journal of the Mechanics and Physics of Solids	2013-08-29	Paper
A homogenization analysis of the field theoretic approach to the quasi-continuum method Journal of the Mechanics and Physics of Solids	2013-08-29	Paper
A homogenization analysis of the field theoretic approach to the quasi-continuum method Journal of the Mechanics and Physics of Solids	2013-08-29	Paper
Approximation of the electron density of aluminium clusters in tensor-product format Journal of Computational Physics	2012-05-18	Paper
Corrigendum to ``Non-periodic finite-element formulation of orbital-free density functional theory [Journal of the Mechanics and Physics of Solids 55, 669-696 (2007; Zbl 1162.74461)] Journal of the Mechanics and Physics of Solids	2011-11-10	Paper
Non-periodic finite-element formulation of Kohn-Sham density functional theory Journal of the Mechanics and Physics of Solids	2010-08-27	Paper
Role of the defect core in energetics of vacancies Proceedings of the Royal Society A: Mathematical, Physical and Engineering Sciences	2010-05-19	Paper
Role of the defect core in energetics of vacancies Proceedings of the Royal Society A: Mathematical, Physical and Engineering Sciences	2010-05-19	Paper
Exponential time propagators for elastodynamics (available as arXiv preprint)	N/A	Paper

Research outcomes over time

This page was built for person: V. Gavini