我室谭元植教授在 JACS 上发表论文：Two Metastable Endohedral Metallofullerenes Sc2C2@C1(39656)-C82 and Sc2C2@C1(51383)-C84: Direct-C2-Insertion Products from Their Most Stable Precursors摘要：Endohedral metallofullerenes (EMFs) are sub-nano carbon materials with diverse applications, yet their formation mechanism, particularly for metastable isomers, remains ambiguous. The current theoretical me...

我室洪文晶教授在 Science Advances 上发表论文：Composition and sequence-controlled conductance of crystalline unimolecular monolayers摘要：Understanding how the charge travels through sequence-controlled molecules has been a formidable challenge because of simultaneous requirements in well-controlled synthesis and well-manipulated orientation. Here, we report electrically driven simultaneous syn...

我室洪文晶教授在 Nature Materials 上发表论文：Single-molecule photoelectron tunnelling spectroscopy摘要：Experimental mapping of transmission is essential for understanding and controlling charge transport through molecular devices and materials. Here we developed a single-molecule photoelectron tunnelling spectroscopy approach for mapping transmission beyond the HOMO–LUMO gap of the single di...

我室洪文晶教授在 Nature Communications 上发表论文：Voltage-driven control of single-molecule keto-enol equilibrium in a two-terminal junction system摘要：Keto-enol tautomerism, describing an equilibrium involving two tautomers with distinctive structures, provides a promising platform for modulating nanoscale charge transport. However, such equilibria are generally dominated by the keto form, w...

我室董全峰教授在 EES 上发表论文：A rooted interphase on sodium via in situ pre-implantation of fluorine atoms for high-performance sodium metal batteries摘要：Sodium plating/stripping with high reversibility is very challenging for sodium-based batteries. Building a robust solid-electrolyte interphase (SEI) film on the surface of a sodium electrode is a pragmatic and effective approach. The exi...

我室郑南峰教授在 Joule 上发表论文：Solvent racing crystallization: Low-solvation dispersion cosolvents for high-quality halide perovskites in photovoltaics摘要：The solvation capacity of dispersion solvents plays a crucial role in the solution processing of metal halide perovskites. For instance, N,N-dimethylformamide (DMF), a widely used dispersion solvent, possesses high solvation capacity bu...

我室田中群教授和毛秉伟教授在 Nature communications 上发表论文：Resolving nanostructure and chemistry of solid-electrolyte interphase on lithium anodes by depth-sensitive plasmon-enhanced Raman spectroscopy摘要：The solid-electrolyte interphase (SEI) plays crucial roles for the reversible operation of lithium metal batteries. However, fundamental understanding of the mechanisms of SEI formation ...

我室乔羽教授在 Joule 上发表论文：Ten concerns of Zn metal anode for rechargeable aqueous zinc batteries摘要：Aqueous Zn-ion batteries are attractive for stationary electrochemical energy storage. However, the poor stability/reversibility of the Zn-metal anode (ZMA), owing to dendrite growth and free-water-induced side reactions, and some ambiguous and even misunderstood issues related to the el...

 我室詹东平教授在 Advanced materials 上发表论文：In-situ Electropolymerized Three-Dimensional Microporous Cobalt-Porphyrin Nanofilm for Highly Effective Molecular Electrocatalytic Reduction of Carbon Dioxide摘要：Electrocatalytic CO2 reduction reaction (CO2RR) based on molecular catalysts, e.g., cobalt porphyrin, is a promising approach to enhance carbon cycle and mitigate climate crisis. Howev...

我室梁万珍教授和赵仪教授在 JCTC 上发表论文：Electronic Couplings for Singlet Fission Processes Based on the Fragment Particle-Hole Densities摘要：A new diabatization scheme is proposed to calculate the electronic couplings for the singlet fission process in multichromophoric systems. In this approach, a robust descriptor that treats single and multiple excitations on an equal footing is adopted...