Photocatalytic reduction of carbon dioxide by BiTeX (X= Cl, Br, I) under visible-light irradiation

YY Lin, FY Liu, IC Chen, HY Tsai, JW Huang… - Journal of …, 2024 - Elsevier
In this study, a series of BiTeX (X= Cl, Br, I) photocatalysts were successfully synthesized via
a simple hydrothermal method. The synthesis process involved dissolving BiX 3 and Te …

MPMC and MCMD: Free High‐Performance Simulation Software for Atomistic Systems

DM Franz, JL Belof, K McLaughlin… - Advanced Theory …, 2019 - Wiley Online Library
Advancements in parallel computing and hardware have allowed computational exploration
of chemical systems of interest with unprecendented accuracy and efficiency. The typical …

Synthesis, Characterization, Photocatalytic Activity of Selenium Vacancy in Bisex and Bisex/Go (X= Cl, Br, I) Photocatalysts

YY Lin, HH Huang, ST Huang, FY Liu, JH Lin… - Go (X= Cl, Br, I) … - papers.ssrn.com
Abstract BiSeX (X= Cl, Br, I) belongs to the V–VI–VII compounds, known for their high
dielectric constants, ferroelectric properties, excellent photoconductivity, and well-suited …

[图书][B] Development of Next-Generation, Fast, Accurate, Transferable, and Polarizable Force-fields for Heterogenous Material Simulations

AE Hogan - 2020 - search.proquest.com
Theoretical modeling is extremely useful in guiding to experiment; however quantitatively
accurate modeling of energy-relevant small molecule sorption at the heterogeneous …