# MD

Activate the MD based optimization procedure for BAND [Edit on GitHub]

Subsections

- TEMP_CONTROL
- VEL_CONTROL

## Keywords

- MAX_STEPS

- TEMPERATURE

- TIMESTEP

## Keyword descriptions

MAX_STEPS: integer = 100

  Specify the maximum number of MD steps [Edit on GitHub]

TEMPERATURE: real = 0.00000000E+000 [K]

  Specify the initial temperature [Edit on GitHub]

TIMESTEP: real = 5.00000000E-001 [fs]

  Usage: timestep 1.0

  The length of an integration step [Edit on GitHub]