Planned maintenance on Wednesday, 2021-01-20, 17:00-18:00. Expect some interruptions during that time

Commit 3a982a69 authored by temok-mx's avatar temok-mx

Further update of README.md; mv metadata.yml -> metadata.yaml

parent 93cf2295
......@@ -13,7 +13,7 @@ in the same directory as files that also belong to that entry. Parsers
might also read information from these auxillary files. This way you can add more files
to an entry, even if the respective parser/code might not directly support it.
For cpmd please provide at least the files from this table if applicable to your
For CPMD please provide at least the files from this table if applicable to your
calculations (remember that you can provide more files if you want):
......@@ -49,12 +49,12 @@ import sys
from nomad.cli.parse import parse, normalize_all
# match and run the parser
backend = parse(sys.argv[1])
archive = parse(sys.argv[1])
# run all normalizers
normalize_all(backend)
normalize_all(archive)
# get the 'main section' section_run as a metainfo object
section_run = backend.resource.contents[0].section_run[0]
section_run = archive.section_run[0]
# get the same data as JSON serializable Python dict
python_dict = section_run.m_to_dict()
......@@ -76,3 +76,5 @@ pip install -e parser-cpmd
```
Running the parser now, will use the parser's Python code from the clone project.
codeLabel: CPMD
codeLabelStyle: all in capitals
codeUrl: https://www.cpmd.org/
parserDirName: dependencies/parsers/cpmd/
parserGitUrl: https://gitlab.mpcdf.mpg.de/nomad-lab/parser-cpmd
parserSpecific: ''
tableOfFiles: ''
code-label: CPMD
code-label-style: all in capitals
code-url: https://www.cpmd.org/
parser-dir-name: dependencies/parsers/cpmd/
parser-git-url: https://gitlab.mpcdf.mpg.de/nomad-lab/parser-cpmd
parser-specific: ''
table-of-files: ''
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