[pull] main from dftd3:main

[pull]

See Commits and Changes for more details.

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Created by pull[bot]

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[codecov]

Codecov Report

Attention: Patch coverage is 77.40964% with 300 lines in your changes missing coverage. Please review.

Project coverage is 66.75%. Comparing base (dd8e4a5) to head (70ceeb3).
Report is 15 commits behind head on main.

Files with missing lines	Patch %	Lines
src/dftd3/gcp.f90	85.53%	67 Missing and 34 partials ⚠️
src/dftd3/gcp/param.f90	78.04%	29 Missing and 54 partials ⚠️
app/cli.f90	31.08%	22 Missing and 29 partials ⚠️
app/driver.f90	51.76%	15 Missing and 26 partials ⚠️
src/dftd3/api.f90	66.07%	3 Missing and 16 partials ⚠️
src/dftd3/output.f90	86.11%	0 Missing and 5 partials ⚠️

Additional details and impacted files

@@             Coverage Diff             @@
##             main      #15       +/-   ##
===========================================
+ Coverage   52.08%   66.75%   +14.67%     
===========================================
  Files          24       34       +10     
  Lines        2542     4684     +2142     
  Branches      987     1644      +657     
===========================================
+ Hits         1324     3127     +1803     
+ Misses        877      663      -214     
- Partials      341      894      +553     

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