Third density and acoustic virial coefficients of helium isotopologues from ab initio calculations
arxiv(2024)
摘要
Improved two-body and three-body potentials for helium have been used to
calculate from first principles the third density and acoustic virial
coefficients for both ^4He and ^3He. For the third density virial
coefficient C(T), uncertainties have been reduced by a factor of 4–5
compared to the previous state of the art; the accuracy of first-principles
C(T) now exceeds that of the best experiments by more than two orders of
magnitude. The range of calculations has been extended to temperatures as low
as 0.5 K. For the third acoustic virial coefficient γ_a(T), we applied
the Schlessinger Point Method, which can calculate γ_a and its
uncertainty based on the C(T) data, overcoming some limitations of direct
path-integral calculation. The resulting γ_a are calculated at
temperatures down to 0.5 K; they are consistent with available experimental
data but have much smaller uncertainties. The first-principles data presented
here will enable improvement of primary temperature and pressure metrology
based on gas properties.
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