DFTB+: 20.1

Ben Hourahine; Bálint Aradi; Alessandro Pecchia; Sebastian Ehlert; Franco P. Bonafé; Jan Řezáč; Alex Buccheri; Julian J. Kranz; Adriel Dominguez; Tammo van der Heide; Thomas Kubař; Thomas Niehaus; Izaac Mitchell; Cristopher Camacho; Cristián G. Sánchez; Bálint Aradi; Victor Yu; Caterina Cevallos; Chris Vitkun; Gabrielle Penazzi; Yuri Pankov

doi:10.5281/zenodo.3956552

DFTB+: 20.1

Ben Hourahine (Developer), Bálint Aradi (Developer), Alessandro Pecchia (Photographer), Sebastian Ehlert (Developer), Franco P. Bonafé (Developer), Jan Řezáč (Developer), Alex Buccheri (Developer), Julian J. Kranz (Developer), Adriel Dominguez (Developer), Tammo van der Heide (Developer), Thomas Kubař (Developer), Thomas Niehaus (Developer), Izaac Mitchell (Developer), Cristopher Camacho (Developer), Cristián G. Sánchez (Photographer), Bálint Aradi (Developer), Victor Yu (Developer), Caterina Cevallos (Developer), Chris Vitkun (Developer), Gabrielle Penazzi (Developer)Yuri Pankov

Research output: Non-textual form › Software

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Abstract

[Abstract unavailable]

Original language	English
Place of Publication	[Geneva]
Edition	20.1
Media of output	Online
Size	5.6MB
DOIs	https://doi.org/10.5281/zenodo.3956552
Publication status	Published - 22 Jul 2020

Keywords

dftbplus/dftbplus
software

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10.5281/zenodo.3956552Licence: GNU LGPL 3

dftbplus-20.1Other version, 5.3 MBLicence: GNU LGPL 3

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Hourahine, B. (Developer), Aradi, B. (Developer), Pecchia, A. (Photographer), Ehlert, S. (Developer), Bonafé, F. P. (Developer), Řezáč, J. (Developer), Buccheri, A. (Developer), Kranz, J. J. (Developer), Dominguez, A. (Developer), van der Heide, T. (Developer), Kubař, T. (Developer), Niehaus, T. (Developer), Mitchell, I. (Developer), Camacho, C. (Developer), Sánchez, C. G. (Photographer), Aradi, B. (Developer), Yu, V. (Developer), Cevallos, C. (Developer), Vitkun, C. (Developer), ... Pankov, Y. (Developer). (2020). DFTB+: 20.1. Software, . https://doi.org/10.5281/zenodo.3956552

Hourahine, Ben (Developer) ; Aradi, Bálint (Developer) ; Pecchia, Alessandro (Photographer) ; Ehlert, Sebastian (Developer) ; Bonafé, Franco P. (Developer) ; Řezáč, Jan (Developer) ; Buccheri, Alex (Developer) ; Kranz, Julian J. (Developer) ; Dominguez, Adriel (Developer) ; van der Heide, Tammo (Developer) ; Kubař, Thomas (Developer) ; Niehaus, Thomas (Developer) ; Mitchell, Izaac (Developer) ; Camacho, Cristopher (Developer) ; Sánchez, Cristián G. (Photographer) ; Aradi, Bálint (Developer) ; Yu, Victor (Developer) ; Cevallos, Caterina (Developer) ; Vitkun, Chris (Developer) ; Penazzi, Gabrielle (Developer) ; Pankov, Yuri (Developer). / DFTB+ : 20.1. [Software].

@misc{33a985dcc5624a6198171e02b4fea69c,

title = "DFTB+: 20.1",

abstract = "[Abstract unavailable]",

keywords = "dftbplus/dftbplus, software",

author = "Ben Hourahine and B{\'a}lint Aradi and Alessandro Pecchia and Sebastian Ehlert and Bonaf{\'e}, {Franco P.} and Jan {\v R}ez{\'a}{\v c} and Alex Buccheri and Kranz, {Julian J.} and Adriel Dominguez and {van der Heide}, Tammo and Thomas Kuba{\v r} and Thomas Niehaus and Izaac Mitchell and Cristopher Camacho and S{\'a}nchez, {Cristi{\'a}n G.} and B{\'a}lint Aradi and Victor Yu and Caterina Cevallos and Chris Vitkun and Gabrielle Penazzi and Yuri Pankov",

year = "2020",

month = jul,

day = "22",

doi = "10.5281/zenodo.3956552",

language = "English",

edition = "20.1",

}

DFTB+ : 20.1. Hourahine, Ben (Developer); Aradi, Bálint (Developer); Pecchia, Alessandro (Photographer); Ehlert, Sebastian (Developer); Bonafé, Franco P. (Developer); Řezáč, Jan (Developer); Buccheri, Alex (Developer); Kranz, Julian J. (Developer); Dominguez, Adriel (Developer); van der Heide, Tammo (Developer); Kubař, Thomas (Developer); Niehaus, Thomas (Developer); Mitchell, Izaac (Developer); Camacho, Cristopher (Developer); Sánchez, Cristián G. (Photographer); Aradi, Bálint (Developer); Yu, Victor (Developer); Cevallos, Caterina (Developer); Vitkun, Chris (Developer); Penazzi, Gabrielle (Developer); Pankov, Yuri (Developer). 2020. [Geneva].

Research output: Non-textual form › Software

TY - ADVS

T1 - DFTB+

T2 - 20.1

A2 - Hourahine, Ben

A2 - Aradi, Bálint

A2 - Pecchia, Alessandro

A2 - Ehlert, Sebastian

A2 - Bonafé, Franco P.

A2 - Řezáč, Jan

A2 - Buccheri, Alex

A2 - Kranz, Julian J.

A2 - Dominguez, Adriel

A2 - van der Heide, Tammo

A2 - Kubař, Thomas

A2 - Niehaus, Thomas

A2 - Mitchell, Izaac

A2 - Camacho, Cristopher

A2 - Sánchez, Cristián G.

A2 - Aradi, Bálint

A2 - Yu, Victor

A2 - Cevallos, Caterina

A2 - Vitkun, Chris

A2 - Penazzi, Gabrielle

A2 - Pankov, Yuri

PY - 2020/7/22

Y1 - 2020/7/22

N2 - [Abstract unavailable]

AB - [Abstract unavailable]

KW - dftbplus/dftbplus

KW - software

UR - https://doi.org/10.1063/1.5143190

U2 - 10.5281/zenodo.3956552

DO - 10.5281/zenodo.3956552

M3 - Software

CY - [Geneva]

ER -

DFTB+: 20.1

Abstract

Keywords

Access to Document

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DFTB+, a software package for efficient approximate density functional theory based atomistic simulations

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