Symposium A: High-Efficiency Materials Computation and Design

• GPUMD software and its applications to materials calculations 2024.11.16
• The Progress and Outlook of ABACUS First-Principles Calculation Software 2024.12.31
• Development of Quantum Chemical Methods and Their Applications in Research of Energy and Environ... 2024.11.16
• First-Principles Material Simulation Driven by Algorithms and Computing Power 2024.11.26
• AI methods for alloy design: from genetic algorithms to knowledge graphs 2024.11.26
• Mechanism-driven Material Manufacturing 2024.11.26
• High-throughput screening for two-dimensional structures from non-layered materials 2024.11.26
• Computational design of barocaloric materials for solid-state refrigeration 2024.11.26
• ICME Development of Carbon Fiber Composites 2024.11.26
• AI-Assisted Simulation and Design of Disordered Alloy Materials 2024.11.26
• Machine Learning Moment Tensor Potentials for Materials: Code Development and Applications 2024.11.26
• Multi-field coupled phase-field simulation of high temperature alloy 2024.11.26
• Phase field simulations aided multiscale precipitation design in titanium alloys 2024.11.26
• Design of Composition and Microstructure in ZrNbTi-Based Refractory High-Entropy Alloy Films 2024.11.26
• AI-driven theoretical exploration of single-molecule materials and devices 2024.11.26
• Data-driven Design and Performance Regulation of Wear-Resistant Materials 2024.11.26
• Progress on Material Structure Generation via Artificial Intelligence 2024.11.26
• Machine Learning Guided Design and High Throughput Screening of OLED Materials 2024.11.26
• Designing High Thermal Conductive Polymers by Quantum Machine Learning 2024.11.26
• Combing the high-throughput calculations and machine learning study the friction at the interfac... 2024.11.26
• Nonbonding Electron Delocalization Stabilizes the Flexible N8 Assembly 2024.11.26
• Metamaterials design accelerated by AI: Softwares and applications 2024.11.26
• HH130: a Dataset for Universal Machine Learning Force Field and the Applications in the Thermal ... 2024.11.26
• Material genetic engineering leads battery system innovation 2024.11.26
• Data Driven Efficient Designing of Potassium Sodium Niobate Based Ceramics 2024.11.26
• Phase field simulation study in SiC coating process of TRISO fuel 2024.11.26
• Calculation and simulation of multicomponent materials at atomic scale 2024.11.26