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Projects in Awesome Lists by nomad-coe

A curated list of projects in awesome lists by nomad-coe .

https://github.com/nomad-coe/nomad

NOMAD lets you manage and share your materials science data in a way that makes it truly useful to you, your group, and the community.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/greenx

Library for Green’s function based electronic structure theory calculations

exascale fortran greens-functions

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-schema-plugin-example

This is an example for NOMAD schema plugins. It should be forked to create actual plugins.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/pyzeo

Python interface for the zeo++ package

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-plugin-example

This is an example for NOMAD parser plugins. It should be forked to create actual plugins.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/materia

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-simulations

A NOMAD plugin containing base sections for simulations.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-example

An example parser that can be forked to bootstrap new parsers for NOMAD.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/doctoral_school_paphos_2023

Repository for the doctoral summer school in Paphos (Cyprus) 3-8 October 2023, "Towards exascale solutions in Green function methods and advanced DFT"

Last synced: 11 Nov 2024

https://github.com/nomad-coe/matid

Last synced: 28 Oct 2024

https://github.com/nomad-coe/nomad-parser-fplo

This is a NOMAD parser for FPLO. It will read FPLO input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-cp2k

This is a NOMAD parser for CP2K. It will read CP2K input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-msspec

NOMAD parser plugin for MsSpec input/output files.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-quantum-espresso

This is a NOMAD parser for QUANTUM ESPRESSO. It will read QUANTUM ESPRESSO input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-gaussian

This is a NOMAD parser for Gaussian. It will read Gaussian input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-crystal

This is a NOMAD parser for CRYSTAL. It will read CRYSTAL input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-onetep

This is a NOMAD parser for ONETEP. It will read ONETEP input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-xps

This is a NOMAD parser for XPS data. It will read XPS files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-qbox

This is a NOMAD parser for Qbox. It will read Qbox input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-molcas

This is a NOMAD parser for Molcas. It will read Molcas input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-turbomole

This is a NOMAD parser for TURBOMOLE. It will read TURBOMOLE input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-wien2k

This is a NOMAD parser for WIEN2k. It will read WIEN2k input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-siesta

This is a NOMAD parser for SIESTA. It will read SIESTA input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-octopus

This is a NOMAD parser for Octopus. It will read Octopus input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-exciting

This is a NOMAD parser for exciting. It will read exciting input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-phonopy

This is a NOMAD parser for Phonopy. It will read Phonopy input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-namd

This is a NOMAD parser for NAMD. It will read NAMD input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-openkim

This is a NOMAD parser for openKIM. It will read openKIM input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-mpes

This is a NOMAD parser for MPES. It will read MPES input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-abinit

This is a NOMAD parser for ABINIT. It will read ABINIT input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-mopac

This is a NOMAD parser for MOPAC. It will read MOPAC input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-gromacs

This is a NOMAD parser for GROMACS. It will read GROMACS input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-band

This is a NOMAD parser for BAND. It will read BAND input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-nwchem

This is a NOMAD parser for NWChem. It will read NWChem input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-fhi-aims

This is a NOMAD parser for FHI-aims. It will read FHI-aims input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-gromos

This is a NOMAD parser for GROMOS. It will read GROMOS input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-vasp

This is a NOMAD parser for VASP. It will read VASP input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-fleur

This is a NOMAD parser for Fleur. It will read Fleur input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-aptfim

This is a NOMAD parser for APTFIM. It will read APTFIM input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-em-ebsd

Nomad parser for EM EBSD

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-lammps

This is a NOMAD parser for LAMMPS. It will read LAMMPS input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-dl-poly

This is a NOMAD parser for DL_POLY. It will read DL_POLY input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-asap

This is a NOMAD parser for ASAP. It will read ASAP input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-elk

This is a NOMAD parser for Elk. It will read Elk input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-dmol3

This is a NOMAD parser for DMol3 . It will read DMol3 input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-amber

This is a NOMAD parser for Amber. It will read Amber input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-cpmd

This is a NOMAD parser for CPMD. It will read CPMD input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-castep

This is a NOMAD parser for CASTEP. It will read CASTEP input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-aptfim-leap

This is a NOMAD parser for APTFIM-LEAP. It will read APTFIM-LEAP input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/doctoral_school_cea_bruyeres_2024

Repository for the doctoral school at the CEA Bruyeres-le-chatel (France), 29 Jan - 2 Feb 2024, "Towards ab initio simulations on exascale supercomputer"s

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-aflow

This is a NOMAD parser for AFLOW. It will read AFLOW input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-dftbplus

This is a NOMAD parser for DFTB+. It will read DFTB+ input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-atk

This is a NOMAD parser for AtomistixToolKit. It will read AtomistixToolKit input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-em-nbed

This is a NOMAD parser for EM-NBED. It will read EM-NBED input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-lib-atoms

This is a NOMAD parser for libAtoms. It will read libAtoms input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-gulp

This is a NOMAD parser for GULP. It will read GULP input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-bigdft

This is a NOMAD parser for BigDFT. It will read BigDFT input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-gpaw

This is a NOMAD parser for GPAW. It will read GPAW input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-charmm

This is a NOMAD parser for CHARMM. It will read CHARMM input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-elastic

This is a NOMAD parser for ElaStic. It will read ElaStic input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-gamess

This is a NOMAD parser for GAMESS. It will read GAMESS input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/wp3-cc4s

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-orca

This is a NOMAD parser for ORCA. It will read ORCA input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-eelsdb

This is a NOMAD parser for EELSDB. It will read EELSDB input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-molpro-plugin

Standalone NOMAD plugin for parsing MOLPRO calculation files

Last synced: 11 Nov 2024

https://github.com/nomad-coe/nomad-parser-tinker

This is a NOMAD parser for Tinker. It will read Tinker input and output files and provide all information in NOMAD's unified Metainfo based Archive format.

Last synced: 11 Nov 2024