CONVERGENCE_CONTROL

Setup parameters to control the convergence criteria for BAND [Edit on GitHub]

Keywords

MAX_DR: real = 2.00000000E-004 

Usage: MAX_DR {real}

Tolerance on the maximum value of the displacement on the BAND. [Edit on GitHub]

MAX_FORCE: real = 4.50000000E-004 

Usage: MAX_FORCE {real}

Tolerance on the maximum value of Forces on the BAND. [Edit on GitHub]

RMS_DR: real = 1.00000000E-004 

Usage: RMS_DR {real}

Tolerance on RMS displacements on the BAND. [Edit on GitHub]

RMS_FORCE: real = 3.00000000E-004 

Usage: RMS_FORCE {real}

Tolerance on RMS Forces on the BAND. [Edit on GitHub]