Predicting the suitability of photocatalysts for water splitting using Koopma...

B2FIND2026-03-19 收录

光催化水分解

催化剂性能预测

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https://b2find.eudat.eu/dataset/17bc95ff-56d4-5af9-ad42-c08292be7845 数据链接链接失效反馈

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<p>Photocatalytic water splitting has attracted considerable attention for renewable energy production. Since the first reported photocatalytic water splitting by titanium...

DataSheet1_The First-Principles Study of External Strain Tuning the Electronic and Optical Properties of the 2D MoTe2/PtS2 van der Waals Heterostructure.docx

光催化水分解

材料电子结构

Two-dimensional van der Waals (vdW) heterostructures reveal novel properties due to their unique interface, which have attracted extensive focus. In this work, the first-principles methods are explore

NIAID Data Ecosystem80

Dataset for Research on the Design of Catalysts for Electrochemical NO Reduction to Ammonia Based on Stacked Ensemble Learning

催化合成

催化剂性能预测

Electrocatalytic reduction of nitric oxide for ammonia synthesis (NORR), as a core technology in the field of green energy conversion, relies on the development of highly efficient NORR electrocatalys

科学数据银行2025-10-30 更新40

Bridging Adsorption Analytics and Catalytic Kinetics for Metal-Exchanged Zeolites

催化剂性能预测

废气处理催化

Understanding the structure-properties relationships of metal-exchanged zeolites is a challenging task. Here, correlations are established between the adsorption properties of Cu-ZSM5 and the reaction

NIAID Data Ecosystem20

压电光催化

光催化水分解

Dataset related to the article "Quasihorizontal projectile motion of carriers in two-dimensional piezoelectric photocatalyst Janus GeN₂-XY monolayers for water splitting"

Figshare2025-10-14 更新50

Computational Investigation into Heteroleptic Photoredox Catalysts Based on Nickel(II) Tris-Pyridinethiolate for Water Splitting Reactions

光催化水分解

催化剂理论计算

This work demonstrates a strategy to fine-tune the efficiency of a photoredox water splitting Ni(II) tris-pyridinethiolate catalyst through heteroleptic ligand design using computational investigation

NIAID Data Ecosystem40

Predicting the suitability of photocatalysts for water splitting using Koopma...

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