100 cont errors from pyiron lammps log #102

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JFRudzinski wants to merge 2 commits into develop from 100-cont-errors-from-pyiron-lammps-log

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JFRudzinski commented Mar 28, 2024

adding support for velocity generation parameters in gromacs and lammps
may also add support for temperature ramping in this MR

JFRudzinski added 2 commits

March 28, 2024 10:51


          added initialization parameters to gromacs

ceac9a7


          added vel init and tests to lammps

a958b59

JFRudzinski self-assigned this

JFRudzinski added the backlog label

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