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The victory project v1.0: An efficient parquet equations solver
Victory, i.e. vienna computational tool depository, is a collection of numerical tools for solving the parquet equations for the Hubbard model and similar many body problems. In the current release, w
NIAID Data Ecosystem90
Implementation of the SU(2) Hamiltonian symmetry for the DMRG algorithm
Abstract In the Density Matrix Renormalization Group (DMRG) algorithm (White, 1992, 1993) [1,2], Hamiltonian symmetries play an important rôle. Using symmetries, the matrix representation of the Ham
NIAID Data Ecosystem50
On a classical limit for electronic degrees of freedom that satisfies the Pauli exclusion principle
Fermions need to satisfy the Pauli exclusion principle: no two can be in the same state. This restriction is most compactly expressed in a second quantization formalism by the requirement that the cre
PubMed Central2000-02-29 更新40
Data supporting Figure 5 of "Simple Fermionic backflow states via a systematically improvable tensor decomposition"
Ground state energies for the 6x6 hydrogen lattice in the STO-6G basis set at different interatomic distances obtained by the following methods:variational Monte Carlo (VMC) with the CPD backflow ansa
DataCite Commons2025-03-04 更新60
Multiconfigurational Self-Consistent Field Theory with Density Matrix Embedding: The Localized Active Space Self-Consistent Field Method
Density matrix embedding theory (DMET) is a fully quantum-mechanical embedding method which shows great promise as a method of defeating the inherent exponential cost scaling of multiconfigurational w
Figshare2019-02-04 更新40
