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Uncoupling system and environment simulation cells for fast-scaling modeling of complex continuum embeddings
Article describes how continuum solvation models are becoming increasingly relevant in condensed matter simulations, allowing to characterize materials interfaces in the presence of wet electrified environments at a reduced computational cost with respect to all atomistic simulations. However, some challenges with the implementation of these models in plane-wave simulation packages still persists, and to address these challenges, the authors present the implementation of a double-cell formalism, in which the simulation cell used for the continuum environment is uncoupled from the one used for the electronic-structure simulation of the quantum-mechanical system.
Date:
August 1, 2023
Creator:
Medrano, G.; Bainglass, E. & Andreussi, O.
Object Type:
Article
System:
The UNT Digital Library
Scaling Students' Self-Efficacy on Machine Translation Post-Editing: Psychometric Properties of the Scale and Their Associations
Article describes how Machine Translation Post-Editing has emerged as a productivity-enhancing practice in the language service industry, where human editors correct the output of machine translation systems. this research paper aims to assess students' self-efficacy in translation learning, specifically in the context of MTPE, and explore the factor structure, psychometric properties, and internal associations of their self-efficacy.
Date:
November 1, 2023
Creator:
Li, Qing & Huang, Tai-yi
Object Type:
Article
System:
The UNT Digital Library