7623203216
64%

Ran 23 Jan 2024 08:52AM UTC

Jobs 1

Files 26

Run time 2s

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Committed 12 Jan 2024 12:30PM UTC coverage: 62.383% (+8.7%) from 53.715%

Build # 7623203216

Build Type

push

github

Committed by

web-flow

Commit Message

Velocity settings (#76)

* remove `rescale` and `aimless` options in velocity generation, meaning we now only support aimless shooting and we do not support rescaling the energy to match some total energy at the shooting point

* add the H2 dissociation example to all engines, which will be used to make a heavy test later

* read in velocity settings from the .toml, fixes #8

* make lammpsengine aware of `exe_dir`, fixes #74 

* add internal velocity generation in gromacs, resolves #16 

* Add unit tests for velocities, one heavy

Run Details

2743 of 4397 relevant lines covered (62.38%)

0.62 hits per line

Jobs

ID	Job ID	Ran	Files	Coverage
1	7623203216.1	23 Jan 2024 08:52AM UTC	0	62.38

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