Zhi Deng

TL;DR: A comprehensive evaluation of ML-IAPs based on four local environment descriptors --- atom-centered symmetry functions (ACSF), smooth overlap of atomic positions (SOAP), the Spectral Neighbor Analysis Potential (SNAP) bispectrum components, and moment tensors --- using a diverse data set generated using high-throughput density functional theory (DFT) calculations.

TL;DR: In this article, the authors provide an in-depth, critical review of ML-guided design and discovery of energy materials, a field where a novel material with superior performance (e.g., higher energy density, higher energy conversion efficiency, etc.) can have a transformative impact on the urgent global problem of climate change.

TL;DR: In this article, the elastic properties of 23 well-known ceramic superionic superionic conductor electrolytes (SICEs) were investigated using first principles calculations. And they found that the computed elastic moduli are in good agreement with experimental data and chemical bonding nature.

TL;DR: It is demonstrated that an all-solid-state TiS2/t-Na3−xPS4−xClx/Na cell utilizing this solid electrolyte can be cycled at room-temperature at a rate of C/10 with a capacity of about 80 mAh g−1 over 10 cycles.

TL;DR: In this paper, the phase stability, dopant formation energy and Na+ conductivity of pristine and doped cubic Na3PS4 (c-Na3PS 4) were investigated.