Scuseria, Gustavo - Rice University - Department of Chemistry

个人简介

B.S., M.S. (1979) University of Buenos Aires Ph.D. (1983) University of Buenos Aires

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Density matrix embedding theory from broken symmetry mean fields, I. W. Bulik, G. E. Scuseria, and J. Dukelsky, Phys. Rev. B 89, 035140 (2014). Stability of Hemi-Bonded versus Proton-Transferred Structures of (H2O)+2, (H2S)+2 and (H2Se)+2 studied with Projected Hartree-Fock Methods, T. Stein, C. A. Jiménez-Hoyos, and G. E. Scuseria, J. Phys. Chem. A (2014). The isotropic molecular polarizabilities of single methyl-branched alkanes in the terahertz range, D. V. Nickel, A. J. Garza, G. E. Scuseria, and D. M. Mittleman, Chem. Phys. Lett. 592, 292-296 (2014). A Computational Study of the Nonlinear Optical Properties of Carbazole Derivatives: Theory Refines Experiment, A. J. Garza, O. I. Osman, N. A. Wazzan, S. B. Khan, A. M. Asiri, and G. E. Scuseria, Theor. Chem. Acc. 133, 1458 (2014). Coupled cluster channels in the homogeneous electron gas, J. J. Shepherd, T. M. Henderson, and G. E. Scuseria, J. Chem. Phys. 140, 124101 (2014). Symmetry-projected wavefunctions in Quantum Monte Carlo calculations, H. Shi, C. A. Jiménez-Hoyos, R. R. Rodríguez-Guzmán, G. E. Scuseria, and S. Zhang, Phys. Rev. B 89, 125129 (2014). Range Separated Brueckner Coupled Cluster Doubles Theory, J. J. Shepherd, T. M. Henderson, and G. E. Scuseria, Phys. Rev. Lett. 112, 133002 (2014). Quasiparticle coupled cluster theory for pairing interactions, T. M. Henderson, G. E. Scuseria, J. Dukelsky, A. Signoracci, and T. Duguet, Phys. Rev. C 89, 054305 (2014). Multi-reference symmetry-projected variational approximation for ground states of the doped one-dimensional Hubbard model, R. R. Rodríguez-Guzmán, C. A. Jiménez-Hoyos, and G. E. Scuseria, Phys Rev. B 89, 195109 (2014). Analytic energy gradient for the projected Hartree-Fock method, R. Schutski, C. A. Jiménez-Hoyos, and G. E. Scuseria, J. Chem. Phys. 140, 204101 (2014). Seniority zero pair coupled cluster doubles theory, T. Stein, T. M. Henderson, and G. E. Scuseria, J. Chem. Phys. 140, 214113 (2014). Electronic correlation without double counting via a combination of spin projected Hartree-Fock and density functional theories, A. J. Garza, C. A. Jiménez-Hoyos, and G. E. Scuseria, J. Chem. Phys. 140, 244102 (2014). Prediction of the linear and nonlinear optical properties of tetrahydronaphthalone derivatives via long-range corrected hybrid functionals, A. J. Garza, O. I. Osman, N. A. Wazzan, S. B. Khan, A. M. Asiri, and G. E. Scuseria, Mol. Phys. 112, 3165-3172 (2014). Electron correlation in solids via density embedding theory, I. W. Bulik, W. Chen, and G. E. Scuseria, J. Chem. Phys. 141 054113 (2014). Composite fermion-boson mapping for fermionic lattice models, J. Zhao, C. A. Jiménez-Hoyos, G. E. Scuseria, D. Huerga, J. Dukelsky, S. M. A. Rombouts, and G. Ortiz, J. Phys.: Condens. Matt. 26, 455601 (2014). Polyradical character and spin frustration in fullerene molecules: An ab initio non-collinear Hartree-Fock study, C. A. Jiménez-Hoyos, R. R. Rodríguez-Guzmán, and G. E. Scuseria, J. Phys. Chem. A 118, 9925-9940 (2014). The sign problem in full configuration interaction quantum Monte Carlo: Linear and sub-linear representation regimes for the exact wave function, J. J. Shepherd, G. E. Scuseria, and J. S. Spencer, Phys. Rev. B 90, 155130 (2014). Variational description of the ground state of the repulsive two-dimensional Hubbard model in terms of non-orthogonal symmetry-projected Slater determinants, R. R. Rodríguez-Guzmán, C. A. Jiménez-Hoyos, and G. E. Scuseria, Phys. Rev. B 90, 195110 (2014). Can short- and middle-range hybrids describe the hyperpolarizabilities of long-range charge transfer compounds? A. J. Garza, N. A. Wazzan, A. M. Asiri, and G. E. Scuseria, J. Phys. Chem. A 118, 11787-11796 (2014). Seniority-based coupled cluster theory, T. M. Henderson, I. W. Bulik, T. Stein, and G. E. Scuseria, J. Chem. Phys. 141, 244104 (2014). x. Can gap tuning schemes of long-range corrected hybrid functionals improve the description of hyperpolarizabilities? A. J. Garza, O. I. Osman, A. M. Asiri, and G. E. Scuseria, J. Phys. Chem. B http://pubs.acs.org/doi/abs/10.1021/jp507226v