首页> 外文期刊>Journal of Physics, B. Atomic, Molecular and Optical Physics: An Institute of Physics Journal >Benchmark helium dimer and trimer calculations with a public few-body code
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Benchmark helium dimer and trimer calculations with a public few-body code

机译:公开的少体代码基准氦二聚体和三聚体计算

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摘要

We present detailed calculations of bound and scattering states of dimers and trimers of He to produce highly accurate data and to test a non-relativistic three-body code currently in development for public distribution. For these systems, uncertainties and inaccuracies in the fundamental constants frequently used in published works can substantially exceed numerical errors. Our benchmark calculations include specific estimates of the numerical accuracy of the calculations and also explore sensitivity to fundamental constants and their uncertainties. The use of an inexact coupling constant in the previous calculations leads to 0.08% error for the ground state energy, 0.3% error for the excited state energy and up to 0.15% error for the atom-dimer scattering length in the system of three ~4He atoms. The corresponding errors for the asymmetric ~4He _2 ~3He system are 0.3% for the bound state energy and 0.03% for the atom-dimer scattering length.
机译:我们提供He的二聚体和三聚体的结合和散射状态的详细计算,以生成高度准确的数据并测试当前正在开发中的,用于公共发行的非相对论三体代码。对于这些系统,已发表作品中经常使用的基本常数的不确定性和不准确性可能会大大超过数值误差。我们的基准计算包括对计算数值准确性的具体估计,还探讨了对基本常数及其不确定性的敏感性。在先前的计算中使用不精确的耦合常数会导致在3〜4He的系统中,基态能量的误差为0.08%,激发态能量的误差为0.3%,原子二聚体散射长度的误差高达0.15%。原子。非对称〜4He _2〜3He系统的相应误差对于束缚态能量为0.3%,对于原子二聚体散射长度为0.03%。

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