Simple-average expressions for shear-stress relaxation modulus


Abstract in English

Focusing on isotropic elastic networks we propose a novel simple-average expression $G(t) = mu_A - h(t)$ for the computational determination of the shear-stress relaxation modulus $G(t)$ of a classical elastic solid or fluid and its equilibrium modulus $G_{eq} = lim_{t to infty} G(t)$. Here, $mu_A = G(0)$ characterizes the shear transformation of the system at $t=0$ and $h(t)$ the (rescaled) mean-square displacement of the instantaneous shear stress $hat{tau}(t)$ as a function of time $t$. While investigating sampling time effects we also discuss the related expressions in terms of shear-stress autocorrelation functions. We argue finally that our key relation may be readily adapted for more general linear response functions.

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