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

CMASS
ENERGY
GAMMA
PRESSURE
VOLUME
VSHOCK

Keyword descriptions

CMASS: real = 0.00000000E+000 [m_e]

Usage: CMASS real

Effective cell mass [Edit on GitHub]

ENERGY: real = 0.00000000E+000 [hartree]

Usage: ENERGY real

Initial energy [Edit on GitHub]

GAMMA: real = 0.00000000E+000 [fs^-1]

Usage: GAMMA real

Damping coefficient for cell volume [Edit on GitHub]

PRESSURE: real = 0.00000000E+000 [bar]

Usage: PRESSURE real

Initial pressure [Edit on GitHub]

VOLUME: real = 0.00000000E+000 [angstrom^3]

Usage: VOLUME real

Initial volume [Edit on GitHub]

VSHOCK: real = 0.00000000E+000 [s^-1*m]

Aliases: V_SHOCK

Usage: VSHOCK real

Velocity shock [Edit on GitHub]