mpqcinp.dox

大型并行量子化学软件；支持密度泛函（DFT）。可以进行各种量子化学计算。支持CHARMM并行计算。非常具有应用价值。

/** \page mpqcinp MPQC Input

   MPQC supports two input formats.  The primary input is an object
oriented format which gives users access to all of MPQC's options.  The
second format allows access to a subset of MPQC's capabilities, but is more
intuitive and easier to learn.  New users are advised to start with the
simplified format.  MPQC can be used to convert the simplified format to
the full object-oriented format with the <tt>-i</tt> option.

<ul>
  <li> \ref mpqcsimp
  <li> \ref mpqcoo
</ul>

*/