five

Data supporting Figure 5 of "Simple Fermionic backflow states via a systematically improvable tensor decomposition"

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DataCite Commons2025-03-04 更新2025-04-16 收录
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https://kcl.figshare.com/articles/dataset/Data_supporting_Figure_5_of_Simple_Fermionic_backflow_states_via_a_systematically_improvable_tensor_decomposition_/28517510
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资源简介:
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 ansatz using support dimension M=1 and no exchange cutoffVMC with the CPD backflow ansatz using support dimension M=1 and an exchange cutoff K=5VMC with the Gaussian Process state (GPS) multiplied by a Slater determinant using support dimension M=72density matrix renormalization group (DMRG) with the matrix product state tensor network using bond dimension M=1024unrestricted CCSD (UCCSD)restricted Hartree-Fock (RHF)
提供机构:
King's College London
创建时间:
2025-03-04
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