[1] Univ Washington, Dept Chem, Seattle, WA 98195 USA
[2] Univ Florida, Dept Chem, Quantum Theory Project, Gainesville, FL 32611 USA
[3] Univ Florida, Dept Phys, Quantum Theory Project, Gainesville, FL 32611 USA
[4] Los Alamos Natl Lab, CINT, Los Alamos, NM 87545 USA
[5] Los Alamos Natl Lab, T Div, Los Alamos, NM 87545 USA