Friday, August 10, 2007

VMC optimization papers

A recent comment suggested these papers on VMC optimization:


I'd also add these to the pile of papers to read and understand:




And since this post is alread about VMC optimization, some further questions:


  1. What about simultaneous geometry and parameter optimization?

  2. The focus seems to be on single geometries - what's likely more interesting in the future is a family of geometries - has anyone parameterized the VMC parameters (by the bond lengths or nuclear coordinates)?

No comments: