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Capolanco - #33

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capolanco wants to merge 19 commits into

mat3ra:devfrom

capolanco:capolanco

Open

Capolanco#33
capolanco wants to merge 19 commits into
mat3ra:devfrom
capolanco:capolanco

Commits on Oct 13, 2020
- Minor clarification
  timurbazhirov
  committed
  c77f4f8
Commits on Mar 28, 2022
- feat: app infra rewote
  tjduigna
  committed
  3b1e60c
- Merge pull request #21 from Exabyte-io/app-infra-rewote
  tjduigna
  authored
  0c11bc4
Commits on Apr 1, 2022
- feat: rename file
  timurbazhirov
  committed
  75ea0c2
- feat: add cloud infrastructure / HPC rewote
  timurbazhirov
  committed
  4cbf3ea
- feat: updated readme
  timurbazhirov
  committed
  9c83e4a
- feat: add notes to README
  timurbazhirov
  committed
  b91eeff
- fix: github workflow -> action
  timurbazhirov
  committed
  369a81d
- Merge pull request #22 from Exabyte-io/add-cloud-hpc-rewote
  timurbazhirov
  authored
  be8b6ea
Commits on Apr 11, 2022
- fix: typo
  timurbazhirov
  committed
  257f1b5
- feat: add containerization/HPC rewote
  timurbazhirov
  committed
  65b312d
- feat: update README
  timurbazhirov
  committed
  09f975c
- feat: recommend usign Salt, then Terraform
  timurbazhirov
  committed
  b930341
Commits on Apr 12, 2022
- Merge pull request #23 from Exabyte-io/add-another-hpc-rewote
  timurbazhirov
  authored
  b7cdbbc
- fix: typo
  timurbazhirov
  committed
  3d1f875
Commits on Sep 6, 2022
- fix: links in README
  timurbazhirov
  authored
  910655f
Commits on Dec 6, 2022
- Did the initial structe of the code. Create a class to handle QE input files. Create functions to read the input and create other inputs base on the class. For the moment this only works for kgrid.
  cpolanco
  committed
  ddb871b
Commits on Dec 7, 2022
- The core convergence program is working. The code iterates on fictituos files until achieving convergence. This program should work in principle for any valid input given in QE
  cpolanco
  committed
  4932df2
Commits on Dec 8, 2022
- Added support to send the QE calculations to the cluster. For that created a class to handle cluster jobs.
  cpolanco
  committed
  2ab4508

Commits

Commits on Oct 13, 2020

Commits on Mar 28, 2022

Commits on Apr 1, 2022

Commits on Apr 11, 2022

Commits on Apr 12, 2022

Commits on Sep 6, 2022

Commits on Dec 6, 2022

Commits on Dec 7, 2022

Commits on Dec 8, 2022