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The Journal of Chemical Physics|July 9, 2021
Correlation-driven phenomena in periodic molecular systems from variational two-electron reduced density matrix theorySimon Ewing, David A MazziottiPhysical Review Letters|March 17, 2011
Large-scale semidefinite programming for many-electron quantum mechanicsDavid A MazziottiPhysical Review Letters|December 17, 2004
Realization of quantum chemistry without wave functions through first-order semidefinite programmingDavid A MazziottiPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|February 3, 2004
Towards idempotent reduced density matrices via particle-hole duality: McWeeny's purification and beyondDavid A MazziottiThe Journal of Chemical Physics|January 7, 2005
First-order semidefinite programming for the direct determination of two-electron reduced density matrices with application to many-electron atoms and moleculesDavid A MazziottiPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|February 28, 2002
Purification of correlated reduced density matricesDavid A MazziottiPhysical Review Letters|December 31, 2008
Parametrization of the two-electron reduced density matrix for its direct calculation without the many-electron wave functionDavid A MazziottiPhysical Review Letters|October 22, 2016
Enhanced Constraints for Accurate Lower Bounds on Many-Electron Quantum Energies from Variational Two-Electron Reduced Density Matrix TheoryDavid A MazziottiAccounts of Chemical Research|March 22, 2006
Quantum chemistry without wave functions: two-electron reduced density matricesDavid A MazziottiPhysical Review Letters|December 13, 2006
Anti-hermitian contracted schrödinger equation: direct determination of the two-electron reduced density matrices of many-electron moleculesDavid A MazziottiPageof 14