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Reduced density matrix
14
"Symmetry-adapted formulation of the combined G-particle-hole hypervirial equation and Hermitian operator method" (2014) Alcoba, D.R.;Massaccesi, G.E.;Oña, O.B. (...)Torre, A. Journal of Mathematical Chemistry. 52(7):1794-1806
"A new approach to construct the three-body correlation matrices for correlated excited states" (2013) Alcoba, D.R.; Valdemoro, C.; Tel, L.M. Computational and Theoretical Chemistry. 1003:55-61
"Drawing information from the ground state G-particle-hole matrix to study electronic excited states" (2012) Alcoba, D.R.;Oña, O.B.;Valdemoro, C. (...)Massaccesi, G.E. Journal of Mathematical Chemistry. 50(9):2478-2491
"Ionization and double-excitations within the framework of the G-particle-hole hypervirial equation method" (2012) Valdemoro, C.; Alcoba, D.R.; Tel, L.M. International Journal of Quantum Chemistry. 112(17):2965-2970
"Some theoretical questions about the G-particle-hole hypervirial equation" (2011) Valdemoro, C.; Alcoba, D.R.; Tel, L.M.; Paérez-Romero, E. International Journal of Quantum Chemistry. 111(2):245-255
"Convergence and computational efficiency enhancements in the iterative solution of the G-particle-hole hypervirial equation" (2011) Alcoba, D.R.; Tel, L.M.; Pérez-Romero, E.; Valdemoro, C. International Journal of Quantum Chemistry. 111(5):937-949
"The correlation contracted schrodinger equation: An accurate solution of the G-particle-hole hypervirial" (2009) Alcoba, D.R.; Valdemoro, C.; Tel, L.M.; Pérez-Romero, E. International Journal of Quantum Chemistry. 109(14):3178-3190
"The correlation contracted schrodinger equation: An accurate solution of the G-particle-hole hypervirial" (2009) Alcoba, D.R.; Valdemoro, C.; Tel, L.M.; Pérez-Romero, E. International Journal of Quantum Chemistry. 109(14):3178-3190
"Controlling the N - And S -representability of the second-order reduced density matrix: The doublet-state case" (2008) Alcoba, D.R.; Valdemoro, C.; Tel, L.M.; Pérez-Romero, E. Physical Review A - Atomic, Molecular, and Optical Physics. 77(4)
"Energy decompositions according to physical space partitioning schemes: Treatments of the density cumulant" (2007) Alcoba, D.R.; Torre, A.; Lain, L.; Bochicchio, R.C. Journal of Chemical Physics. 127(10)
"The contracted Schrödinger equation methodology: Study of the third-order correlation effects" (2007) Valdemoro, C.; Tel, L.M.; Alcoba, D.R.; Pérez-Romero, E. Theoretical Chemistry Accounts. 118(3):503-509
"Four new forms of the contracted Schrödinger equation and their connection with the second-order hypervirial condition" (2007) Valdemoro, C.; Tel, L.M.; Pérez-Romero, E.; Alcoba, D.R. International Journal of Quantum Chemistry. 108(6):1090-1096
"Four new forms of the contracted Schrödinger equation and their connection with the second-order hypervirial condition" (2007) Valdemoro, C.; Tel, L.M.; Pérez-Romero, E.; Alcoba, D.R. International Journal of Quantum Chemistry. 108(6):1090-1096
"On spin density and hole distribution relations: Valence and free valence" (1998) Bochicchio, R.C. Journal of Molecular Structure: THEOCHEM. 429(1-3):229-236