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Releases: aiidalab/aiidalab-docker-stack

Materials Cloud Docker Stack v18.05.0

16 May 17:38
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Pre-release

This release moves from aiida-core 0.10 to 0.12.

Changelog

  • upgrade aiida-core from 0.10.0 to 0.12.0
  • upgrade reentry from 1.0 to 1.2.
  • upgrade seekpath from 1.6 to 1.8
  • upgrade aiida-quantumespresso from 1.0 to 2.0
  • add aiida-raspa and aiida-zeopp plugins
  • faster initial container setup by loading SSSP from aiida export files
    Note: For the new users the SSSP libraries are now available under the upf family names "SSSP_accuracy_v1.0" and "SSSP_efficiency_v1.0. For the existing users these databases need to be imported manually."
  • For the full list of python packages available inside the python2 environment, see requirements.txt
  • move from Ubuntu 17.04 (end of life) to 17.10

Materials Cloud Docker Stack v18.03.0

15 Mar 19:04
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Pre-release

This release moves from aiida-core 0.10 to 0.11 and from the django to the sqlalchemy backend.

Changelog

  • upgrade aiida-core from v0.10.0 to v0.11.2
  • move from django database backend to more efficient sqlalchemy backend
  • faster initial container setup by loading SSSP from aiida export files
    Note: SSSP libraries are now available under the upf family names "SSSP_accuracy_v1.0" and "SSSP_efficiency_v1.0"
  • For the full list of python packages available inside the python2 environment, see requirements.txt
  • move from Ubuntu 17.04 (end of life) to 17.10

Materials Cloud Docker Stack v17.11.0

09 Mar 20:11
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First release of Docker Stack for jupyter section of Materials Cloud

Version summary

  • aiida v0.10.0 (django backend)
  • SSSP v0.7 (PBE + PBESOL)
  • appmode v0.2.0