output
20172026
most citedIdentifying non-affine softening modes in glassy polymer networks: A pathway to chemical design

23 citations

7 papers

cs.CR2026

Agentic Settlement Protocol: An Application Profile for Refundable, Delayed-Fulfilment Agent Commerce on Stablecoin Rails

Behnam, Mohammadkhani, Atul Khekade +1

Autonomous agents can already pay per request: HTTP-native protocols such as x402 let an agent sign a stablecoin authorization and receive a resource in the same round trip. That m…

cond-mat.dis-nn2020★ 14 cited

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…

cs.LG2020★ 1 cited

Using Deep Learning to Explore Local Physical Similarity for Global-scale Bridging in Thermal-hydraulic Simulation

Han Bao, Nam Dinh, Linyu Lin +3

Current system thermal-hydraulic codes have limited credibility in simulating real plant conditions, especially when the geometry and boundary conditions are extrapolated beyond th…

cond-mat.mtrl-sci2019★ 23 cited

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…

cond-mat.soft2017

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…

cond-mat.soft2017★ 22 cited

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…