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• W2016392046 abstract "The energy of a system which is described by a Hamiltonian which includes at most two-particle interactions can be expressed in terms of the second order reduced density matrix. However, for the 2-matrix to have proper symmetry is a weaker condition than requiring that the wavefunction be antisymmetric, which is called the N-representability problem, a problem of long term interest. Coleman [Reduced Density Matrices: Coulson's Challenge, Springer, New York, 2000] however, proposed an algorithm which ensures N-representability. In this Letter we examine the algorithm and show its connection to the full configuration interaction method and the contracted Schroedinger equation." @default.
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• W2016392046 date "2002-04-01" @default.
• W2016392046 modified "2023-09-27" @default.
• W2016392046 title "Ensuring N-representability: Coleman's algorithm" @default.
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• W2016392046 doi "https://doi.org/10.1016/s0009-2614(02)00239-7" @default.
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