Αποτελέσματα Αναζήτησης
This review article is intended as a practical guide for newcomers to the field of kinetic Monte Carlo (KMC) simulations, and specifically to lattice KMC simulations as prevalently used for surface and interface applications.
5 Απρ 2019 · This review article is intended as a practical guide for newcomers to the eld of kinetic Monte Carlo (KMC) simulations, and speci cally to lattice KMC simulations as prevalently used for surface and interface applications.
8 Kinetic Monte Carlo jobs available on Indeed.com. Apply to Post-doctoral Fellow, Research Scientist, Propulsion Engineer and more!
22 Μαρ 2022 · Kinetic Monte Carlo (KMC) simulations in combination with first-principles (1p)-based calculations are rapidly becoming the gold-standard computational framework for bridging the gap between the wide range of length scales and time scales over which heterogeneous catalysis unfolds. 1p-KMC simulations provide accurate insights into reactions ...
29 Αυγ 2019 · Strong metal–support interactions make Au nanoparticles dispersed on MoC a highly active catalyst for the low-temperature water-gas shift reaction (WGSR). Here, by using kinetic Monte Carlo (kMC) simulations, we unravel the origin of the experimentally observed high WGSR activity of Au/MoC.
2 Μαρ 2022 · Kinetic Monte Carlo (KMC) simulations in combination with first-principles-based calculations are rapidly becoming the gold-standard computational framework for bridging the gap between the...
Provides the first graduate level introduction to kinetic MC simulations applied to surface reactions; Includes both a chapter devoted to examples and to new development; Suitable as self-study text as well as additional reading for surface science courses; Includes supplementary material: sn.pub/extras
