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20202025
most citedInverse Volume Scaling of Finite-Size Error in Periodic Coupled Cluster Theory

12 citations · 47 across the 8 of their papers we have counts for

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math.NA2023★ 12 cited

Inverse Volume Scaling of Finite-Size Error in Periodic Coupled Cluster Theory

Xin Xing, Lin Lin

Coupled cluster theory is one of the most popular post-Hartree-Fock methods for ab initio molecular quantum chemistry. The finite-size error of the correlation energy in periodic c…

math.NA2023★ 5 cited

Finite-size effects in periodic coupled cluster calculations

Xin Xing, Lin Lin

We provide the first rigorous study of the finite-size error in the simplest and representative coupled cluster theory, namely the coupled cluster doubles (CCD) theory, for gapped…