Introducing \texttt{PROFESS 2.0}: a parallelized, fully linear scaling program for orbital-free density functional theory calculations
type: Item
instance of: scholarly article
title: Introducing \texttt{PROFESS 2.0}: a parallelized, fully linear scaling program for orbital-free density functional theory calculations
zbMATH Open document ID: 1219.81264
author: Linda Hung
author: Ilgyou Shin
author: Gregory S. Ho
author: Vincent L. Lignères
author: Emily A. Carter
author: Chen Huang
published in: Computer Physics Communications
publication date: 2011-06-30T00:00:00Z
Mathematics Subject Classification ID: 81V45
Mathematics Subject Classification ID: 81V55
Mathematics Subject Classification ID: 49S05
Mathematics Subject Classification ID: 81T80
Mathematics Subject Classification ID: 81-08
zbMATH DE Number: 5915812
zbMATH Keywords: orbital-free density functional theory
zbMATH Keywords: optimization
zbMATH Keywords: electronic structure
describes a project that uses: PROFESS
MaRDI profile type: Publication
full work available at URL: j.cpc.2010.09.001
OpenAlex ID: W2039091087
DOI: 10.1016/J.CPC.2010.09.001
description: scientific article; zbMATH DE number 5915812