-
Notifications
You must be signed in to change notification settings - Fork 2
/
CITATION.cff
176 lines (175 loc) · 5.88 KB
/
CITATION.cff
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
cff-version: 1.2.0
title: FLEUR
message: >-
If you use this software, please cite it using the
metadata from this file.
type: software
authors:
- given-names: Daniel
family-names: Wortmann
email: [email protected]
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0002-2248-1904'
- given-names: Gregor
family-names: Michalicek
email: [email protected]
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0003-4719-188X'
- given-names: Nadjib
family-names: Baadji
orcid: 'https://orcid.org/0000-0002-0630-2398'
- given-names: Wejdan
family-names: Beida
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0009-0009-3909-8619'
- given-names: Markus
family-names: Betzinger
- given-names: Gustav
family-names: Bihlmayer
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0002-6615-1122'
- given-names: Thomas
family-names: Bornhake
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0009-0002-8467-7029'
- given-names: Jens
family-names: Bröder
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0001-7939-226X'
- given-names: Tobias
family-names: Burnus
orcid: 'https://orcid.org/0000-0002-3206-2797'
- given-names: Jussi
family-names: Enkovaara
orcid: 'https://orcid.org/0000-0002-7596-2891'
- given-names: Frank
family-names: Freimuth
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0001-6193-5991'
- given-names: Christoph
family-names: Friedrich
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0002-3315-7536'
- given-names: Christian-Roman
family-names: Gerhorst
orcid: 'https://orcid.org/0000-0001-8984-4258'
- given-names: Sabastian
family-names: Granberg Cauchi
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0003-0805-3564'
- given-names: Uliana
family-names: Grytsiuk
orcid: 'https://orcid.org/0000-0003-3231-6192'
- given-names: Andrea
family-names: Hanke
orcid: 'https://orcid.org/0000-0003-3439-3706'
- given-names: Jan-Philipp
family-names: Hanke
orcid: 'https://orcid.org/0000-0002-2113-7829'
- given-names: Marcus
family-names: Heide
- given-names: Stefan
family-names: Heinze
affiliation: >-
Institute of Theoretical Physics and Astrophysics,
University of Kiel, D-24098 Kiel, Germany
orcid: 'https://orcid.org/0000-0001-5852-0082'
- given-names: Robin
family-names: Hilgers
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0002-3443-5032'
- given-names: Henning
family-names: Janssen
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0003-3558-9487'
- given-names: Daniel Aaaron
family-names: Klüppelberg
- given-names: Roman
family-names: Kovacik
orcid: 'https://orcid.org/0000-0002-2780-547X'
- given-names: Philipp
family-names: Kurz
- given-names: Marjana
family-names: Lezaic
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0002-7318-9444'
- given-names: Georg K. H.
family-names: Madsen
orcid: 'https://orcid.org/0000-0001-9844-9145'
- given-names: Yuriy
family-names: Mokrousov
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0003-1072-2421'
- given-names: Alexander
family-names: Neukirchen
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0002-0971-8735'
- given-names: Matthias
family-names: Redies
orcid: 'https://orcid.org/0000-0002-6780-6821'
- given-names: Stefan
family-names: Rost
orcid: 'https://orcid.org/0000-0002-3887-4040'
- given-names: Martin
family-names: Schlipf
orcid: 'https://orcid.org/0000-0003-3198-0497'
- given-names: Arno
family-names: Schindlmayr
orcid: 'https://orcid.org/0000-0002-4855-071X'
- given-names: Miriam
family-names: Winkelmann
orcid: 'https://orcid.org/0000-0002-1072-7516'
- given-names: Stefan
family-names: Blügel
email: [email protected]
affiliation: >-
Institute for Advanced Simulation,
Forschungszentrum Jülich, 52425 Jülich, Germany
orcid: 'https://orcid.org/0000-0001-9987-4733'
identifiers:
- type: doi
value: 10.5281/zenodo.7576163
description: DOI of the software publication on zenodo, should always point the the most recent release
repository-code: 'https://iffgit.fz-juelich.de/fleur/fleur'
url: 'https://www.flapw.de'
abstract: >-
FLEUR is an all-electron DFT code based on the
full-potential linearized augmented plane-wave
method (FLAPW). It is mainly developed at the
Forschungsentrum Jülich, Germany and available for
the materials research community.
keywords:
- DFT
- All-electron
- FLAPW
- Density functional theory
- FLEUR
license: MIT