Janesko, Benjamin G <br/><br/>
Hartree-Fock orbitals significantly improve the reaction barrier heights predicted by semilocal density functionals.  [electronic resource] 

 -  The Journal of chemical physics  Jun 2008 
 - 244112 p.  digital 
<br/><br/> Publication Type: Journal Article; Research Support, N.I.H., Extramural; Research Support, Non-U.S. Gov't; Research Support, U.S. Gov't, Non-P.H.S. 
<br/><br/><label>ISSN: </label>1089-7690 
<br/><br/><label>Standard No.: </label>10.1063/1.2940738  doi 
<br/><br/><label>Subjects--Topical Terms: </label><br/>Models, Chemical<br/>Models, Molecular<br/>Quantum Theory