Refined SS-RRR methods with a reliable tune-free removal of spurious Ritz values improve accuracy and efficiency for computing eigenpairs of large Hermitian matrices in a target region.
A Filter Diagonalization for Generalized Eigenvalue Problems Based on the
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A reorganized Hartree-Fock framework imposes tunable orbital locality by pairing local degrees of freedom with local solution conditions, maintaining efficient SCF optimization and competitive reaction-energy accuracy.
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A refined CJ--SS--RR method with a reliable removal approach of spurious Ritz values for the Hermitian eigenvalue problem
Refined SS-RRR methods with a reliable tune-free removal of spurious Ritz values improve accuracy and efficiency for computing eigenpairs of large Hermitian matrices in a target region.
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Approximating Hartree-Fock theory via an efficiently local reformulation
A reorganized Hartree-Fock framework imposes tunable orbital locality by pairing local degrees of freedom with local solution conditions, maintaining efficient SCF optimization and competitive reaction-energy accuracy.