-
Notifications
You must be signed in to change notification settings - Fork 29
/
mkdocs.yml
245 lines (239 loc) · 8.27 KB
/
mkdocs.yml
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
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
215
216
217
218
219
220
221
222
223
224
225
226
227
228
229
230
231
232
233
234
235
236
237
238
239
240
241
242
243
244
245
site_name: XMU Chenggroup Wiki
site_url: https://wiki.cheng-group.net
repo_name: chenggroup/chenggroup.github.io
repo_url: https://github.com/chenggroup/chenggroup.github.io
extra:
social:
- icon: material/web
link: https://www.cheng-group.net
name: 课题组网站
- icon: fontawesome/brands/github
link: https://github.com/chenggroup
name: 课题组Github
- icon: fontawesome/solid/paper-plane
link: mailto:[email protected]
name: 联系程俊老师
alternate:
- name: 中文
link: /
lang: zh
- name: English
link: /en/
lang: en
author_name: '{{ page.meta.authors }}'
plugins:
- search:
separator: '[\s\-\.]'
- macros
- i18n:
docs_structure: suffix
languages:
- locale: zh
default: true
name: 中文
build: true
- locale: en
name: English
build: true
nav_translations:
集群使用: Cluster Usage
开始编辑: How to Edit
新生培训: For New Comers
合作协同: Teamwork
软件安装: Software Installation
软件使用: Software Usage
软件开发: Software Development
研究技能: Research Skills
疑难解答: Troubleshooting
未完待续: To be continued
隐患排查: Question Under Carpet
杂项(Miscellaneous): Miscellaneous
extra:
social:
- icon: material/web
link: https://www.cheng-group.net
name: Group Website
- icon: fontawesome/brands/github
link: https://github.com/chenggroup
name: Group Github Organization
- icon: fontawesome/solid/paper-plane
link: mailto:[email protected]
name: Contact Prof. Jun Cheng
theme:
palette:
- media: "(prefers-color-scheme)"
toggle:
icon: material/brightness-auto
name: Switch to light mode
- media: "(prefers-color-scheme: light)"
scheme: default
primary: teal
toggle:
icon: material/lightbulb
name: Switch to dark mode
- media: "(prefers-color-scheme: dark)"
scheme: slate
primary: blue
toggle:
icon: material/lightbulb-outline
name: Switch to automatic mode
- git-revision-date-localized
theme:
name: material
custom_dir: overrides
icon:
logo: fontawesome/solid/graduation-cap
repo: fontawesome/brands/github
palette:
# Palette toggle for automatic mode
- media: "(prefers-color-scheme)"
toggle:
icon: material/brightness-auto
name: 切换至浅色模式
- media: "(prefers-color-scheme: light)"
scheme: default
primary: teal
toggle:
icon: material/lightbulb
name: 切换至深色模式
- media: "(prefers-color-scheme: dark)"
scheme: slate
primary: blue
toggle:
icon: material/lightbulb-outline
name: 切换至自动模式
favicon: images/favicon.png
language: zh
features:
- navigation.instant
- navigation.sections
- navigation.indexes
- navigation.top
- content.tooltips
- search.suggest
- content.code.annotate
markdown_extensions:
# Python Markdown
- abbr
- admonition
- attr_list
- def_list
- footnotes
- md_in_html
- toc:
permalink: true
# Python Markdown Extensions
- pymdownx.arithmatex:
generic: true
- pymdownx.betterem:
smart_enable: all
- pymdownx.caret
- pymdownx.details
- pymdownx.emoji:
emoji_index: !!python/name:material.extensions.emoji.twemoji
emoji_generator: !!python/name:material.extensions.emoji.to_svg
- pymdownx.highlight
- pymdownx.inlinehilite
- pymdownx.keys
- pymdownx.mark
- pymdownx.smartsymbols
- pymdownx.snippets
- pymdownx.superfences:
custom_fences:
- name: mermaid
class: mermaid
format: !!python/name:pymdownx.superfences.fence_code_format
- pymdownx.tabbed:
alternate_style: true
- pymdownx.tasklist:
custom_checkbox: true
- pymdownx.tilde
extra_javascript:
- javascripts/analytic.js
- javascripts/mathjax.js
- https://unpkg.com/mathjax@3/es5/tex-mml-chtml.js
nav:
- Home: index.md
- Wikis:
- 开始编辑: wiki/how_to_edit/howtodo.md
- 集群使用:
- wiki/cluster_usage/cluster_usage.md
- wiki/cluster_usage/ssh_note.md
- wiki/cluster_usage/gpu_usage.md
- wiki/cluster_usage/conda.md
- wiki/cluster_usage/open_ondemand.md
- wiki/cluster_usage/vscode_remote.md
- wiki/cluster_usage/wsl_usage.md
- wiki/cluster_usage/notification_for_hpc.md
- wiki/cluster_usage/pack_backup.md
- wiki/cluster_usage/tensorboard.md
- 新生培训:
- wiki/new_comers/toc.md
- wiki/new_comers/linux.md
- wiki/new_comers/read_papers.md
- wiki/new_comers/presentation.md
- wiki/new_comers/python_numpy.md
- wiki/new_comers/ase.md
- wiki/new_comers/qc_dft.md
- wiki/new_comers/basis_pps.md
- wiki/new_comers/dpmd.md
- wiki/new_comers/dpgen.md
- wiki/new_comers/workflow.md
- wiki/book_recommendation.md
- 合作协同:
- wiki/teamwork/archive_rules.md
- wiki/teamwork/git_usage.md
- wiki/teamwork/tutorial_rules.md
- 软件使用:
- wiki/software_usage/default_version.md
- wiki/software_usage/MDAnalysis.md
- wiki/software_usage/Tips_for_LaTeX.md
- CP2K:
- wiki/software_usage/cp2k/cp2k.md
- wiki/software_usage/cp2k/cp2k-e-f.md
- wiki/software_usage/cp2k/cp2k-geoopt.md
- wiki/software_usage/cp2k/cp2k-zpe.md
- wiki/software_usage/cp2k/cp2k-neb.md
- wiki/software_usage/cp2k/cp2k-reftraj.md
- wiki/software_usage/cp2k/cp2k-dft+u.md
- wiki/software_usage/cp2k/cp2k-hf.md
- wiki/software_usage/cp2k/cp2k-scan.md
- wiki/software_usage/cp2k/cp2k-slab.md
- wiki/software_usage/cp2k/cp2k-tools.md
- wiki/software_usage/cp2k/cp2k-deepmd.md
- wiki/software_usage/cp2k/cp2k-constrainedmd.md
- wiki/software_usage/DP-GEN.md
- wiki/software_usage/DeePMD-kit.md
- wiki/software_usage/experience_of_dpmd_and_dpgen.md
- wiki/software_usage/i-pi.md
- wiki/software_usage/n2p2.md
- wiki/software_usage/vmd.md
- 软件安装:
- wiki/software_installation/softwares.md
- wiki/software_installation/install_from_src_in_conda.md
- wiki/software_installation/gcc.md
- DeePMD-kit:
- wiki/software_installation/deepmd-kit/deepmd-kit_installation_new.md
- wiki/software_installation/deepmd-kit/deepmd-kit_installation_ikkem.md
- wiki/software_installation/deepmd-kit/deepmd-kit_installation_191.md
- wiki/software_installation/deepmd-kit/deepmd-kit_installation_pc.md
- wiki/software_installation/deepmd-kit/deepmd-kit_installation_51.md
- wiki/software_installation/cp2k-7.1.md
- 软件开发:
- wiki/teamwork/git_usage.md
- Lammps:
- wiki/software_development/lammps/quick_start.md
- wiki/software_development/lammps/installation.md
- wiki/software_development/lammps/plugin.md
- 研究技能:
- wiki/skills/research_skill.md
- wiki/skills/QS4writing.md
- 疑难解答:
- 未完待续: https://github.com/chenggroup/chenggroup.github.io/issues/123
- 隐患排查:
- wiki/question_under_carpet/chemical_computing.md
- 未完待续: https://github.com/chenggroup/chenggroup.github.io/issues/131
- 杂项(Miscellaneous): wiki/miscellaneous.md
- ai2-kit: https://wiki.cheng-group.net/ai2-kit-doc/
- cp2kdata: https://robinzyb.github.io/cp2kdata/
- ECToolkits: https://robinzyb.github.io/ECToolkits/