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arxiv: 2206.03228 · v1 · pith:VKHIC6H7new · submitted 2022-06-07 · ⚛️ physics.comp-ph · cond-mat.quant-gas

Perturbation Calculation of the Uniform Electron Gas with a Transcorrelated Hamiltonian

classification ⚛️ physics.comp-ph cond-mat.quant-gas
keywords methodtranscorrelatedcalculationcorrelationelectronhamiltonianperturbationterm
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With a transcorrelated Hamiltonian, we perform a many body perturbation (MBPT) calculation on the uniform electron gas in the high density regime. By using a correlation factor optimised for a single determinant Jastrow ansatz, the second order correlation energy is calculated as $\frac{1-\ln2}{\pi^{2}}\ln(r_{s})-0.05075$. This already reproduces the exact logarithmic term of the random phase approximation (RPA) result, while the constant term is roughly $7\%$ larger than the RPA one. The close agreement with the RPA method demonstrates that the transcorrelated method offers a viable and potentially efficient method for treating metallic systems.

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