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[HTML][HTML] On-the-fly machine learned force fields for the study of warm dense matter: Application to diffusion and viscosity of CH
We develop a framework for on-the-fly machine learned force field (MLFF) molecular
dynamics (MD) simulations of warm dense matter (WDM). In particular, we employ an MLFF …
dynamics (MD) simulations of warm dense matter (WDM). In particular, we employ an MLFF …
[HTML][HTML] Combining stochastic density functional theory with deep potential molecular dynamics to study warm dense matter
In traditional finite-temperature Kohn–Sham density functional theory (KSDFT), the partial
occupation of a large number of high-energy KS eigenstates restricts the use of first …
occupation of a large number of high-energy KS eigenstates restricts the use of first …
Zone-melting for efficient impurities removal and high-purity aluminum recovery from 7000 series computer numerical control machining scraps
This study investigates zone melting (ZM) as an innovative method for recycling 7000 series
aluminum alloy scraps, a byproduct of computer numerical control (CNC) machining in …
aluminum alloy scraps, a byproduct of computer numerical control (CNC) machining in …