next up previous contents index
Next: Atom.vx x Up: The Atom class: a Previous: The Atom class: a   Contents   Index

Atom.dvx -- objective function derivative

This is the first derivative of the objective function, from the last energy function, with respect to the x coordinate of the atom. Similar members exist for dvy and dvz. (Only available for models, not template structures.)



Automatic builds 2010-04-21