LANGEVIN GAMMA

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LANGEVIN_GAMMA = [Real array]
Default: LANGEVIN_GAMMA = 0×number-of-species in the POTCAR-file. 

Description: LANGEVIN_GAMMA specifies the friction coefficients for the Langevin thermostat (in case VASP was compiled with -Dtbdyn).

The Langevin thermostat[1] (MDALGO=3)


Related Tags and Sections

LANGEVIN_GAMMA_L, MDALGO

References

  1. ↑ M. P. Allen and D. J. Tildesley, Computer simulation of liquids, Oxford university press: New York, 1991.

Contents

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