Results 61 to 70 of about 3,750 (200)

The Screening of Homo‐ and Hetero‐Dual Atoms Anchored Graphdiyne for Boosting Electrochemical CO2 Reduction

open access: yesAdvanced Materials Interfaces, 2023
Developing electrocatalysts with high catalytic performance and selectivity is crucial for electrochemical CO2 reduction reaction (CRR). There are many catalyst studies of transition metal (TM) atom doping to sp2 carbon material, such as graphene or ...
Thanadol Jitwatanasirikul   +5 more
doaj   +1 more source

Advancements in Graphdiyne‐Based Multiscale Catalysts for Green Hydrogen Energy Conversion

open access: yesAdvanced Intelligent Discovery, EarlyView.
This review systematically explores the fundamental characteristics of graphdiyne (GDY), cutting‐edge field of GDY‐based multiscale catalysts within sustainable energy conversion systems.Special emphasis is placed on the structure‒property relationships in different reactions.
Qian Xiao, Lu Qi, Siao Chen, Yurui Xue
wiley   +1 more source

Nanodroplets Behavior on Graphdiyne Membranes [PDF]

open access: yesMRS Advances, 2017
In this work we have investigated, by fully atomistic reactive (force field ReaxFF) molecular dynamics simulations, some aspects of impact dynamics of water nanodroplets on graphdiyne-like membranes. We simulated graphdiyne-supported membranes impacted by nanodroplets at different velocities (from 100 up to 1500 m/s).
Jaques, Ygor M., Galvao, Douglas S.
openaire   +2 more sources

A flexible self-powered humidity sensor with graphdiyne oxide

open access: yesChemPhysMater
Humidity sensors are widely used in various fields of research. However, continuous power supplementation remains a significant challenge for further development.
Jin Zhang   +5 more
doaj   +1 more source

Highly Efficient Van Der Waals Heterojunction on Graphdiyne toward the High‐Performance Photodetector

open access: yesAdvanced Science, 2023
Graphdiyne (GDY), a new 2D material, has recently proven excellent performance in photodetector applications due to its direct bandgap and high mobility.
Dinh Phuc Do   +14 more
doaj   +1 more source

Graphdiyne-Based All-Solid-State Passively Q-Switched Tm:YAP Laser at 2 μm

open access: yesNanomaterials, 2023
All-solid-state Tm lasers have a wider wavelength range and higher output power compared to other types of lasers. In this work, we demonstrate an all-solid-state, high repetition, Tm:YAP laser Q-switched by a graphdiyne (GDY) saturable absorber.
Qing Wu   +5 more
doaj   +1 more source

Flat band in twisted bilayer Bravais lattices

open access: yes, 2019
Band engineering in twisted bilayers of the five generic two-dimensional Bravais networks is demonstrated. We first derive symmetry-based constraints on the interlayer coupling, which helps us to predict and understand the shape of the potential barrier ...
Kariyado, Toshikaze, Vishwanath, Ashvin
core   +1 more source

Machine Learning‐Assisted Second‐Order Perturbation Theory for Chemical Potential Correction Toward Hubbard U Determination

open access: yesAdvanced Intelligent Discovery, EarlyView.
In this work, the Doubao large language model (LLM) is involved in the formula derivation processes for Hubbard U determination regarding the second‐order perturbations of the chemical potential. The core ML tool is optimized for physical domain knowledge, which is not limited to parameter prediction but rather serves as an interactive physical theory ...
Mingzi Sun   +8 more
wiley   +1 more source

Ir0/graphdiyne atomic interface for selective epoxidation

open access: yesNational Science Review, 2023
ABSTRACT The development of catalysts that can selectively and efficiently promote the alkene epoxidation at ambient temperatures and pressures is an important promising path to renewable synthesis of various chemical products. Here we report a new type of zerovalent atom catalysts comprised of zerovalent Ir atoms highly dispersed and ...
Zhiqiang Zheng   +6 more
openaire   +2 more sources

Can two-dimensional graphdiyne-based materials be novel materials for perovskite solar cell applications?

open access: yesMaterials Futures, 2023
Two-dimensional (2D) graphdiyne (GDY)-based materials have attracted attention in the solar cell research community owing to their unique physicochemical properties and hydrophobic nature which can serve as moisture resistance from the surrounding medium.
Eng Liang Lim, Zhanhua Wei
doaj   +1 more source

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