CRYSTAL23: A program for computational solid state physics and chemistry
The Crystal program for quantum-mechanical simulations of materials has been bridging the
realm of molecular quantum chemistry to the realm of solid state physics for many years …
realm of molecular quantum chemistry to the realm of solid state physics for many years …
Efficient and stable perovskite solar cells by tailoring of interfaces
The interface tailoring is crucial for the efficiency and stability of Perovskite Solar Cells
(PSCs). The reported interface engineering primarily focuses on the energy level turning …
(PSCs). The reported interface engineering primarily focuses on the energy level turning …
An extensive study on multiple ETL and HTL layers to design and simulation of high-performance lead-free CsSnCl3-based perovskite solar cells
Cesium tin chloride (CsSnCl3) is a potential and competitive absorber material for lead-free
perovskite solar cells (PSCs). The full potential of CsSnCl3 not yet been realized owing to …
perovskite solar cells (PSCs). The full potential of CsSnCl3 not yet been realized owing to …
A dual‐functional organic electrolyte additive with regulating suitable overpotential for building highly reversible aqueous zinc ion batteries
Z Liu, R Wang, Q Ma, J Wan, S Zhang… - Advanced Functional …, 2024 - Wiley Online Library
Aqueous zinc ion batteries (AZIBs) with high safety, low cost, and eco‐friendliness
advantages show great potential in large‐scale energy storage systems. However, their …
advantages show great potential in large‐scale energy storage systems. However, their …
Energy-saving hydrogen production by seawater electrolysis coupling tip-enhanced electric field promoted electrocatalytic sulfion oxidation
Hydrogen production by seawater electrolysis is significantly hindered by high energy costs
and undesirable detrimental chlorine chemistry in seawater. In this work, energy-saving …
and undesirable detrimental chlorine chemistry in seawater. In this work, energy-saving …
Effect of Various Electron and Hole Transport Layers on the Performance of CsPbI3-Based Perovskite Solar Cells: A Numerical Investigation in DFT, SCAPS-1D, and …
CsPbI3 has recently received tremendous attention as a possible absorber of perovskite
solar cells (PSCs). However, CsPbI3-based PSCs have yet to achieve the high performance …
solar cells (PSCs). However, CsPbI3-based PSCs have yet to achieve the high performance …
Defect engineering in wide-bandgap perovskites for efficient perovskite–silicon tandem solar cells
Abstract Wide-bandgap (WBG) mixed-halide perovskites show promise of realizing efficient
tandem solar cells but at present suffer from large open-circuit voltage loss and the …
tandem solar cells but at present suffer from large open-circuit voltage loss and the …
Subnanometer high-entropy alloy nanowires enable remarkable hydrogen oxidation catalysis
C Zhan, Y Xu, L Bu, H Zhu, Y Feng, T Yang… - Nature …, 2021 - nature.com
High-entropy alloys (HEAs) with unique physicochemical properties have attracted
tremendous attention in many fields, yet the precise control on dimension and morphology at …
tremendous attention in many fields, yet the precise control on dimension and morphology at …
Fluorinated porous frameworks enable robust anode-less sodium metal batteries
Sodium metal batteries hold great promise for energy-dense and low-cost energy storage
technology but are severely impeded by catastrophic dendrite issue. State-of-the-art …
technology but are severely impeded by catastrophic dendrite issue. State-of-the-art …
Photovoltaically top-performing perovskite crystal facets
Discovering the top-performing facets of perovskite crystals holds the secret to highly
efficient perovskite solar cells (PSCs). However, the dominated facet properties of perovskite …
efficient perovskite solar cells (PSCs). However, the dominated facet properties of perovskite …