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Abstract： We present a theoretical model that describes how nonelectrostatic (van der Waals) interactions of electrolyte ions influence adsorption of the ions at electrode surfa...

Abstract：  Harnessing quantum coherence and prethermalization has emerged as a cross-cutting theme for discovering and controlling emergent, even thermodynamically forbidde...

Abstract： 　　Manipulating physical properties using the spin degree of freedom constitutes a major part of modern condensed matter physics and is very important for spintronics...

Abstract: 　　Vanadium dioxide (VO2) has been drawing attention since its metal-insulator transition (MIT) with several orders of magnitude resistivity change at 341 K was discove...

　　应张振宇教授的邀请，6月27日，美国田纳西大学Prof. GAO Yanfei来研究中心进行学术交流与访问，并为师生们作题为“Nanomechanics of Atomic Friction”的学术报告。

Abstract： 　　Understanding excited state phenomena is at the heart of many important materials problems, such as photovoltaics, photocatalysis, plasmonics and solid-state lighti...

Abstract： Bulk rutile RuO2 has long been considered a Pauli paramagnet. Here we report that RuO2 exhibits a hitherto undetected lattice distortion below approximately 900 K [1]....

　　应张振宇教授的邀请，6月26日，美国普林斯顿大学Prof. Weinan E来研究中心进行学术交流与访问，并为师生们作题为“Machine Learning and Multi-scale Modeling”的学术报告...

Abstract: 　　For well-defined contacts with sizes less than hundreds of nanometers, the friction force-displacement curves are characterized by the stick-slip behavior, which are...

Abstract: 　　Density functional theory based first principles calculation provides a powerful tool to design and understand solid state materials from atomistic scale. In this se...

Abstract： Multi-scale modeling is an ambitious program that aims at unifying the different physical models at different scales for the practical purpose of developing accurate m...

　　应朱文光教授的邀请，6月20日，香港科技大学Prof. PAN Ding来研究中心进行学术交流与访问，并为师生们作题为“Raman spectroscopy and multipole interactions determining mole...

　　应严以京教授的邀请，6月20日，美国新墨西哥大学Prof.GUO Hua来研究中心进行学术交流与访问，并为师生们作题为“Chemical Reactivity at Low Temperatures: From Potential Ener...

Abstract:We present a review of the recently developed landscape and flux theory for non-equilibrium dynamical systems. We point out that the global natures of the associated dynam...

Abstract: 　　Knowledge of molecular polarizabilities in condensed phases provides important information about molecular crystals, and in general about materials composed of molec...