Machine learning: accelerating materials development for energy storage and conversion
With the development of modern society, the requirement for energy has become
increasingly important on a global scale. Therefore, the exploration of novel materials for …
increasingly important on a global scale. Therefore, the exploration of novel materials for …
Computational functionality‐driven design of semiconductors for optoelectronic applications
The rapid development of the semiconductor industry has motivated researchers passion for
accelerating the discovery of advanced optoelectronic materials. Computational functionality …
accelerating the discovery of advanced optoelectronic materials. Computational functionality …
Enhancing the photocatalytic activity of Ruddlesden-Popper Sr2TiO4 for hydrogen evolution through synergistic silver doping and moderate reducing pretreatment
The photocatalytic hydrogen (H 2) generation relies heavily on the properties of
photocatalysts, including their light absorption, charge transport, and oxygen vacancy of …
photocatalysts, including their light absorption, charge transport, and oxygen vacancy of …
Structurally tunable two-dimensional layered perovskites: from confinement and enhanced charge transport to prolonged hot carrier cooling dynamics
AO El-Ballouli, OM Bakr… - The journal of physical …, 2020 - ACS Publications
Two-dimensional (2D) layered metal halide perovskites are potential alternatives to three-
dimensional perovskites in optoelectronic applications owing to their improved …
dimensional perovskites in optoelectronic applications owing to their improved …
Temperature dependent negative permittivity in solid solutions Sr2Mn1-xSnxO4 (x= 0, 0.3, 0.5)
A few compositions of the system Sr 2 Mn 1-x Sn x O 4 (x= 0.0, 0.3, 0.5) were synthesized in
the air by the solid-state ceramic route. A change in the sign (positive to negative) of the …
the air by the solid-state ceramic route. A change in the sign (positive to negative) of the …
Variation of the electrocatalytic activity of isostructural oxides Sr 2 LaFeMnO 7 and Sr 2 LaCoMnO 7 for hydrogen and oxygen-evolution reactions
CCW Kananke-Gamage, F Ramezanipour - Dalton Transactions, 2021 - pubs.rsc.org
The effect of the electronic configurations of transition metals on electrocatalytic activity,
charge transport, and magnetic properties is demonstrated through the investigation of …
charge transport, and magnetic properties is demonstrated through the investigation of …
High-throughput computational screening of oxide double perovskites for optoelectronic and photocatalysis applications
X Jiang, WJ Yin - Journal of Energy Chemistry, 2021 - Elsevier
Oxide double perovskites A 2 B′ B′′ O 6 are a class of emerging materials in the fields of
optoelectronics and catalysis. Due to the chemical flexibilities of perovskite structures, there …
optoelectronics and catalysis. Due to the chemical flexibilities of perovskite structures, there …
Relating the structure, properties, and activities of nanostructured SrTiO 3 and SrO–(SrTiO 3) n (n= 1 and 2) for photocatalytic hydrogen evolution
This study focuses on relating the structure of perovskite oxides with their properties and
activities and provides a comparative study of the three members of the Sr–Ti–O system for …
activities and provides a comparative study of the three members of the Sr–Ti–O system for …
Knowledge-reused transfer learning for molecular and materials science
Leveraging big data analytics and advanced algorithms to accelerate and optimize the
process of molecular and materials design, synthesis, and application has revolutionized the …
process of molecular and materials design, synthesis, and application has revolutionized the …
Quantitative Evaluation of the Carrier Separation Performance of Heterojunction Photocatalysts: The Case of gC3N4/SrTiO3
F Bian, X Wu, Z Yang, S Shao, X Meng… - The Journal of Physical …, 2023 - ACS Publications
Heterojunction photocatalysts are of great interest in the energy and environmental fields,
because of their potential to significantly increase the efficiency of harvesting solar energy …
because of their potential to significantly increase the efficiency of harvesting solar energy …