1 |
The exchange energy of a uniform electron gas experiencing a new, flexible range separation Parkhill JA, Chai JD, Dutoi AD, Head-Gordon M Chemical Physics Letters, 478(4-6), 283, 2009 |
2 |
A study of the effect of attenuation curvature on molecular correlation energies by introducing an explicit cutoff radius into two-electron integrals Dutoi AD, Head-Gordon M Journal of Physical Chemistry A, 112(10), 2110, 2008 |
3 |
Self-interaction error of local density functionals for alkali-halide dissociation Dutoi AD, Head-Gordon M Chemical Physics Letters, 422(1-3), 230, 2006 |
4 |
Scaled opposite-spin second order Moller-Plesset correlation energy: An economical electronic structure method Jung YS, Lochan RC, Dutoi AD, Head-Gordon M Journal of Chemical Physics, 121(20), 9793, 2004 |
5 |
An orbital-based definition of radical and multiradical character Dutoi AD, Jung YS, Head-Gordon M Journal of Physical Chemistry A, 108(46), 10270, 2004 |
6 |
Geometry of simple molecules: Nonbonded interactions, not bonding orbitals, and primarily determine observed geometries See RF, Dutoi AD, McConnell KW, Naylor RM Journal of the American Chemical Society, 123(12), 2839, 2001 |