[ase-users] vasp langevin_gamma(_L) parameter

[Otto Kohulák]

Dear ASE users,

I wanted to do some NpT-MD with vasp calculator. According to the vasp user
guide
<https://cms.mpi.univie.ac.at/wiki/index.php/MDALGO#MDALGO.3D3:_Langevin_thermostat>
there is only one thermostat supporting also barostat: langevin (MDALGO =
3). To specify friction coefficients to the langevin thermostat one has to
set parameter LANGEVIN_GAMMA and LANGEVIN_GAMMA_L. However these parameters
are not supported in vasp ase calculator (not in branch ase/master). Am I
right?

Sincerely

Otto Kohulák
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