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292019-03

First-principles molecular dynamics simulations of liquid water and lithium

报告介绍 Abstract：　　We perform first-principles molecular dynamics (MD) simulations on liquid water and lithium based on Kohn-Sham density functional theory (KSDFT) and...
282019-03

低维量子结构的构筑及其物性调控研究

报告介绍
212019-03

拓扑声子晶体

报告介绍报告摘要：　　拓扑电子物态是当前凝聚态及材料物理领域的重要关注焦点。声子晶体是具有宏观周期性结构的人工材料，其中的声子态或声波态也可具有异于寻常的拓扑性质。本报告...
212019-03

Electrical and optical stimuli induced effects in perovskites

报告介绍 Abstract：　　Perovskites include a family of functional materials with ABX3 structure. Barium titanite (BaTiO3) is a typical inorganic ferroelectric perovskite t...
182019-03

Towards ideal topological materials: Comprehensive database searches using s...

报告介绍 Abstract：　　Although the richness of spatial symmetries has led to a rapidly expanding inventory of possible topological crystalline (TC) phases of electrons, p...
152019-03

Atomistic processes in the (electro-)chemical energy conversion and storage:...

报告介绍 Abstract:　　Structures and processes at surfaces and interfaces are often crucial for the performance of functional materials. Understanding these processes on a...
062019-03

Oxygen Driven Fragment Coupling by Activation of C-H, N-H, and O-H Bonds

报告介绍 Abstract：　　Nature uses oxidative couplings to construct carbon-carbon, carbon-oxygen, and carbon-nitrogen bonds with a high degree of efficiency. Surprisingly,...
182019-01

Low-temperature nano-imaging of polaritons and correlated electrons in quant...

报告介绍 Abstract:　　Bypassing the diffraction limit of conventional limit of light, near-field microscopy has emerged as an invaluable tool for nanometer-resolved optica...
182019-01

THz near-field nano-imaging and nano-spectroscopy

报告介绍 Abstract:　　Over the past decade, optical near-field techniques, especially the scattering-type scanning near-field optical microscope (s-SNOM), have undergone t...
162019-01

Linear and second order responses in topological semimetals

报告介绍 Abstract:　　We have found that the strong spin Hall effect in TaAs is mainly dominated from the Weyl points and nodal-line-like Fermi surface, which implies a st...
092019-01

Real-Time Time-Dependent Density Functional Theory Calculations

报告介绍 Abstract：　　Real-time time-dependent density functional theory (RT-TDDFT) is known to be hindered by the very small time step (attosecond or smaller) needed in ...
052019-01

When Single Atom Meets 2D materials: from STM Study to Single Atom Catalysis

报告介绍报告摘要：　　When singleatom meets 2D materials, many exotic physical and chemical properties emerge inthis hybrid system, which makes it highly desirable for a ...
032019-01

Quantum and mesoscopic transport in “engineered” nano-electronic devices

报告介绍 Abstract：　　In this talk, I will presentour recent experimental observations of the large-scale mesoscopic transport innanostructured graphene, and tunnelling s...
032019-01

Getting Something for Nothing: Classical and Machine-Learning Methods for Qu...

报告介绍 Abstract:　　A focus of my research is to thedevelop simulation methods that reveal the mechanistic details of quantummechanical reactions that are central to bio...
252018-12

Emergent phenomena in transition metal oxides

报告介绍 Abstract：　　Transition metal oxides exhibit a wide range of exotic phenomena from metal-insulator transition, colossal magnetoresistance to high-temperat...
212018-12

Synchrotron-based ARPES on Topological Insulators and Semimetals

报告介绍 Abstract：　　The Paul Scherrer Institute (PSI) runs Switzerland's Large-Scale research facilities for users from the domestic and international scientific ...

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