23 citations · 59 across the 4 of their papers we have counts for
4 papers
Scaling up the lattice dynamics of amorphous materials by orders of magnitude
Ivan Kriuchevskyi, Vladimir V. Palyulin, Rico Milkus +3
We generalise the non-affine theory of viscoelasticity for use with large, well-sampled systems of arbitrary chemical complexity. Having in mind predictions of mechanical and vibra…
Identifying non-affine softening modes in glassy polymer networks: A pathway to chemical design
Robert M. Elder, Alessio Zaccone, Timothy W. Sirk
Using molecular simulations and theory, we develop an explicit mapping of the contribution of molecular relaxation modes in glassy thermosets to the shear modulus, where the relaxa…
Parameter-free predictions of the viscoelastic response of glassy polymers from non-affine lattice dynamics
Vladimir V. Palyulin, Christopher Ness, Rico Milkus +3
We study the viscoelastic response of amorphous polymers using theory and simulations. By accounting for internal stresses and considering instantaneous normal modes (INMs) within…
Nonmonotonic dependence of polymer glass mechanical response on chain bending stiffness
Christopher Ness, Vladimir V. Palyulin, Rico Milkus +3
We investigate the mechanical properties of amorphous polymers by means of coarse-grained simulations and nonaffine lattice dynamics theory. A small increase of polymer chain bendi…