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![\begin{boxedminipage}{\textwidth}
\begin{verbatim}call test_energy(pot1,pot2,at_bulk,log, &
[at_def,def_no])\end{verbatim}
\end{boxedminipage}](img1505.png)
- pot1, pot2 -- type(Potential), intent(inout)
-
- at_bulk -- type(Atoms), intent(inout)
-
- log -- type(Inoutput), intent(inout)
-
- at_def -- type(Atoms), intent(inout), optional
-
- def_no -- integer, intent(in), optional
-
evaluate_energies subroutine
gabor
2009-06-30