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

Type: real
Default: 0.00000000E+000 [m_e]
Usage: CMASS real

Description: Effective cell mass

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ENERGY

Type: real
Default: 0.00000000E+000 [hartree]
Usage: ENERGY real

Description: Initial energy

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GAMMA

Type: real
Default: 0.00000000E+000 [fs^-1]
Usage: GAMMA real

Description: Damping coefficient for cell volume

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PRESSURE

Type: real
Default: 0.00000000E+000 [bar]
Usage: PRESSURE real

Description: Initial pressure

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VOLUME

Type: real
Default: 0.00000000E+000 [angstrom^3]
Usage: VOLUME real

Description: Initial volume

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VSHOCK

Type: real
Default: 0.00000000E+000 [s^-1*m]
Aliases: V_SHOCK
Usage: VSHOCK real

Description: Velocity shock

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