Density functional theory for electrocatalysis
X Liao, R Lu, L ** in hydrogenated amorphous silicon for over 25% efficiency silicon solar cells
Recent achievements in amorphous/crystalline silicon heterojunction (SHJ) solar cells and
perovskite/SHJ tandem solar cells place hydrogenated amorphous silicon (a-Si: H) at the …
perovskite/SHJ tandem solar cells place hydrogenated amorphous silicon (a-Si: H) at the …
Strain-regulated Gibbs free energy enables reversible redox chemistry of chalcogenides for sodium ion batteries
M Jiang, Y Hu, B Mao, Y Wang, Z Yang, T Meng… - Nature …, 2022 - nature.com
Manipulating the reversible redox chemistry of transition metal dichalcogenides for energy
storage often faces great challenges as it is difficult to regulate the discharged products …
storage often faces great challenges as it is difficult to regulate the discharged products …
Single Mo atom supported on defective boron nitride monolayer as an efficient electrocatalyst for nitrogen fixation: a computational study
The production of ammonia (NH3) from molecular dinitrogen (N2) under mild conditions is
one of the most attractive and challenging processes in chemistry. Here by means of density …
one of the most attractive and challenging processes in chemistry. Here by means of density …