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nomad-lab / parser-molcas
Apache License 2.0NOMAD Laboratory CoE parser for Molcas
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nomad-lab / parser-gromacs
Apache License 2.0archived 0Updated -
This repository contains the tutorials for the NOMAD analytics toolkit
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nomad-lab / parser-phonopy
Apache License 2.0Recongnize, extract and analyze phonopy calculations in the NOMAD lab
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local version of https://github.com/atztogo/phonopy with some fixes not yet in the upstream
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A manager for containers. Written in nodejs.
Manages beaker, zeppelin and Creedo docker containers. Uses the container per type per user architecture.
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nomad-lab / passport-saml
MIT Licensefork of passport-saml to support the extra info of the NOMAD identity provider (just a quick hack done by Harsha, should probably be replaced)
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nomad-lab / parser-quasi-harmonic-properties
Apache License 2.0Parser for quasi harmonic properties
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nomad-lab / normalizer-stats
Apache License 2.0normalizer creating statistics info for the whole archive
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nomad-lab / parser-elastic
Apache License 2.0NOMAD CoE parser for the program "elastic" that calculates elastic constants
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nomad-lab / normalizer-springer
Apache License 2.0Adds data extracted from the springer materials database to the normalized data
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nomad-lab / normalizer-fhi-aims-basis
Apache License 2.0Computes labels for the basis set
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nomad-lab / normalizer-band-structure
Apache License 2.0Normalizes the band structure
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nomad-lab / normalizer-prototypes
Apache License 2.0Adds prototype labels to a structure
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