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16 Open 41 Closed
16 Open 41 Closed
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Issues list

Compile regexp in normalize_key
#131 opened Mar 26, 2024 by oerc0122
Add more code recipes
#117 opened Oct 31, 2023 by oerc0122
Code Restructure
#115 opened Oct 23, 2023 by oerc0122
1
Parse elastic SCF enhancement New feature or request
#112 opened Oct 20, 2023 by oerc0122
1
Parse delocalised geomopt enhancement New feature or request
#111 opened Oct 20, 2023 by oerc0122
Parse PIMD data enhancement New feature or request
#110 opened Oct 20, 2023 by oerc0122
Parse Delta SCF data enhancement New feature or request
#109 opened Oct 20, 2023 by oerc0122
1
Parse verbose CoM removal enhancement New feature or request
#108 opened Oct 20, 2023 by oerc0122
1
Parse TSS Table enhancement New feature or request
#107 opened Oct 20, 2023 by oerc0122
Refactor
#106 opened Oct 20, 2023 by oerc0122
1
Add filters to .castep parser
#86 opened Aug 19, 2023 by oerc0122
1
Check against various continuation runs
#83 opened Aug 19, 2023 by oerc0122
SCF incorrectly reports energy_gain null vs fermi_energy bug Something isn't working
#82 opened Aug 19, 2023 by oerc0122
Add automated PyPI deployment
#48 opened Aug 9, 2023 by oerc0122
Add sphinx documentation
#10 opened Jul 21, 2023 by oerc0122
Verify applicability over Verbosities
#1 opened Jul 14, 2023 by oerc0122
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