633 citations · 3.3k across the 59 of their papers we have counts for
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cond-mat.mtrl-sci2011★ 93 cited
Improved Semiconductor Lattice Parameters and Band Gaps from a Middle-Range Screened Hybrid Functional
Melissa J. Lucero, Thomas M. Henderson, Gustavo E. Scuseria
We show that the middle-range exchange-correlation hybrid of Henderson, Izmaylov, Scuseria and Savin (HISS) performs extremely well for elemental and binary semiconductors with nar…
cond-mat.str-el2011★ 176 cited
Projected Quasiparticle Theory for Molecular Electronic Structure
Gustavo E. Scuseria, Carlos A. Jimenez-Hoyos, Thomas M. Henderson +2
We derive and implement symmetry-projected Hartree-Fock-Bogoliubov (HFB) equations and apply them to the molecular electronic structure problem. All symmetries (particle number, sp…