MSST
Parameters for Multi-Scale Shock Technique (MSST) which simulate the effect of a steady planar shock on a unit cell. Reed et. al. Physical Review Letters 90, 235503 (2003). [Edit on GitHub]
Keywords
Keyword descriptions
CMASS
Type: real
Default: 0.00000000E+000 [m_e]
Usage: CMASS real
Description: Effective cell mass [Edit on GitHub]
ENERGY
Type: real
Default: 0.00000000E+000 [hartree]
Usage: ENERGY real
Description: Initial energy [Edit on GitHub]
GAMMA
Type: real
Default: 0.00000000E+000 [fs^-1]
Usage: GAMMA real
Description: Damping coefficient for cell volume [Edit on GitHub]
PRESSURE
Type: real
Default: 0.00000000E+000 [bar]
Usage: PRESSURE real
Description: Initial pressure [Edit on GitHub]
VOLUME
Type: real
Default: 0.00000000E+000 [angstrom^3]
Usage: VOLUME real
Description: Initial volume [Edit on GitHub]
VSHOCK
Type: real
Default: 0.00000000E+000 [s^-1*m]
Aliases: V_SHOCK
Usage: VSHOCK real
Description: Velocity shock [Edit on GitHub]