Parameters for calculating rigidAtomicField

In nanodcal, rigidAtomicField are the terms of the Hamiltonian that need to be calculated only once, e.g. outside the self-consistent loop.

calculation.rigidAtomicField.[none]

key word

:

calculation.rigidAtomicField.[none]

default value

:

description

:

It is self-contained and no parameter needed for

the calculation. rigidAtomicField are the potentials

which need to be computed only once, outside the

DFT self-consistent field (SCF) cycle.