Molecularly engineered potential of d-orbital modulated iron-bridged delaminated MBene for rechargeable Zn–air batteries
An air cathode with high catalytic activity and reversibility toward the oxygen evolution
reaction (OER) and oxygen reduction reaction (ORR) is designed using an engineered Fe d …
reaction (OER) and oxygen reduction reaction (ORR) is designed using an engineered Fe d …
Back‐gated van der Waals heterojunction manipulates local charges toward fine‐tuning hydrogen evolution
J Huang, Z Zhuang, Y Zhao, J Chen, Z Zhuo… - Angewandte …, 2022 - Wiley Online Library
Charge redistribution plays a prominent role in interpreting the intrinsic electrocatalytic
mechanism. Establishing a quantitative relationship between the local charges and …
mechanism. Establishing a quantitative relationship between the local charges and …
Tuning Fe-spin state of FeN4 structure by axial bonds as efficient catalyst in Li-S batteries
G Qu, K Guo, J Dong, H Huang, P Yuan, Y Wang… - Energy Storage …, 2023 - Elsevier
In lithium-sulfur (Li-S) batteries, the root-cause solution is to accelerate the polysulfide
conversion to their end products by electrocatalysts. Herein, we put forward a molecular spin …
conversion to their end products by electrocatalysts. Herein, we put forward a molecular spin …
Coupled Yu–Shiba–Rusinov States in Molecular Dimers on NbSe2
Magnetic impurities have a dramatic effect on superconductivity by breaking the time-
reversal symmetry and inducing so-called Yu–Shiba–Rusinov (YSR) low energy bound …
reversal symmetry and inducing so-called Yu–Shiba–Rusinov (YSR) low energy bound …
Transition metal disulfide (MoTe2, MoSe2 and MoS2) were modified to improve NO2 gas sensitivity sensing
L Lin, Z Feng, Z Dong, H Tao, C Hu - Journal of Industrial and Engineering …, 2023 - Elsevier
For the detection of the more hazardous nitrogen oxides (NO 2), there is a need to find a
readily fabricated, low-cost, high-performance two-dimensional material. This paper …
readily fabricated, low-cost, high-performance two-dimensional material. This paper …
MoS2 do** for enhanced H2S detection
MJ Szary - Applied Surface Science, 2021 - Elsevier
Resistive gas sensors based on sheets of MoS 2 were shown to achieve excellent sensitivity
and high selectivity of detection for NO 2 and NH 3. However, due to the low electric …
and high selectivity of detection for NO 2 and NH 3. However, due to the low electric …
Phthalocyanine and metal phthalocyanines adsorbed on graphene: a density functional study
S Feng, N Luo, A Tang, W Chen, Y Zhang… - The Journal of …, 2019 - ACS Publications
Geometries of phthalocyanine (Pc) and metal (M= Cu, Fe, Zn, and Sn) Pc (MPc) adsorption
on graphene have been studied using van der Waals density functional theory, which takes …
on graphene have been studied using van der Waals density functional theory, which takes …
Unusual electronic properties of cellulose nanocrystals conjugated to cobalt phthalocyanine: long-lived charge separation and visible-light-driven photocatalytic …
KM Alam, P Kumar, N Chaulagain, S Zeng… - The Journal of …, 2022 - ACS Publications
Octacarboxylated cobalt phthalocyanine (CoPc) was covalently conjugated to cellulose
nanocrystals (CNCs) by employing an esterification protocol. Solid-state NMR, X-ray …
nanocrystals (CNCs) by employing an esterification protocol. Solid-state NMR, X-ray …
Quasiparticle electronic structure of phthalocyanine: TMD interfaces from first-principles GW
Interfaces formed between monolayer transition metal dichalcogenides and (metallo)
phthalocyanine molecules are promising in energy applications and provide a platform for …
phthalocyanine molecules are promising in energy applications and provide a platform for …
Tuning the electronic properties of molybdenum di-sulphide monolayers via do** using first-principles calculations
In 2D semiconductors, do** offers an effective approach for modulating their structural and
electronic properties-owing to the creation of newly formed chemical bonds and bond …
electronic properties-owing to the creation of newly formed chemical bonds and bond …