v0.1.6

What's Changed

• Fix upload_experimental_data by @superstar54 in #23

Full Changelog: v0.1.5...v0.1.6

v0.1.5

What's Changed

• XPS result panel adds structure view and table by @superstar54 in #21

Full Changelog: v0.1.4...v0.1.5

v0.1.4

What's Changed

• Add post-install to install xps pseudos by @superstar54 in #19

Full Changelog: v0.1.3...v0.1.4

v0.1.3

What's Changed

• Handle new protocol from aiida-qe by @superstar54 in #18

Full Changelog: v0.1.2...v0.1.3

v0.1.2

Full Changelog: v0.1.1...v0.1.2

v0.1.1

What's Changed

• [docs] XPS calculation for selected atoms by @superstar54 in #15
• [XPS] support multiple core levels for the same element by @superstar54 in #16

Full Changelog: v0.1.0...v0.1.1

v0.1.0

What's Changed

• XAS: Migrate AiiDAlab XAS App to new Repository by @PNOGillespie in #9
• Update organization and README by @superstar54 in #10
• Fix import and add example for xps molecule by @superstar54 in #11
• XAS: Update Imports and Apply Minor Fixes by @PNOGillespie in #12
• XAS: Migrate XAS App to New Repository by @PNOGillespie in #13
• XAS: Remove Unnecessary Duplicate of BasePwCpInputGenerator by @PNOGillespie in #14

Full Changelog: v0.1.0a1...v0.1.0

v0.1.0a1

What's Changed

• Add pyproject and pre-commit by @superstar54 in #1
• Migrate the XPS plugins from aiidalab-qe to here by @superstar54 in #2
• Add XPS workflow by @superstar54 in #3
• Add docs and related config files by @superstar54 in #4
• Add ci and python-publish workflow by @superstar54 in #6
• Add the AiiDA-QE XAS Workflows by @PNOGillespie in #5
• First working version of xps WorkChain by @superstar54 in #7

New Contributors

• @superstar54 made their first contribution in #1
• @PNOGillespie made their first contribution in #5

Full Changelog: https://github.com/aiidalab/aiida-qe-xspec/commits/v0.1.0a1