Polyolefins, the dominant class of synthetic polymers, remain entirely dependent on fossil fuels throughout their lifecycle. Developing green manufacturing solutions is the long-sought aspiration to reduce the carbon footprint of polyolefins and alleviate dependence on petroleum resources. Herein, electron-rich phosphi...
Chiral organic-inorganic hybrid metal halides are highly promising candidates for second-order nonlinear optical (NLO) materials. However, their NLO performance is fundamentally restricted by the limited structural polarization inherent to traditional pseudo-octahedral coordination. In this work, we demonstrate the fea...
Jia Zhang, Wen-Qing Han, Lin Li et al.· Angewandte Chemie· 0 citations
Garnet-type Li7La3Zr2O12 (LLZO) is a promising solid electrolyte, but its highly conductive cubic phase is metastable at room temperature. We investigate lithium-ion migration mechanisms in LLZO using machine-learning molecular dynamics (MLMD), which achieves near-AIMD accuracy while enabling nanosecond-scale simulat...
Yujie Chen, Ke R. Yang· ACS Materials Letters· 0 citations
We use cookies to run the site and, with your consent, for analytics and to show ads.
See our Cookie Policy.