Talks
Our YouTube channel.
Video Presentations
► Computational Design Principles for Na-Ion Conductors
"Design principles for sodium superionic conductors", Nature Communications, 14, 7615 (2023)
► Density of Atomistic States (DOAS) for Understanding and Designing Materials with Disordering
"Frustration in Super-Ionic Conductors Unraveled by the Density of Atomistic States", Angewandte Chemie Int. Ed. 62, e202215544 (2023)
► Concerted Ion Migration in Super-Ionic Conductors
"Origin of Fast Ion Diffusion in Super-Ionic Conductors", Nature Communications, 8, 15893 (2017)
► Machine-Learning Discovery of Li-Ion Conductors
"Unsupervised Discovery of Solid-State Lithium Ion Conductors", Nature Communications, 10, 5260 (2019)
► High-throughput Discovery of Li-Ion Conductors
Xingfeng He, Qiang Bai, Yunsheng Liu, Adelaide M. Nolan, Chen Ling, Yifei Mo*, "Crystal Structural Framework of Lithium Super-Ionic Conductors", Advanced Energy Materials 9, 1902078 (2019) (Featured Inside Front Cover)
► Computation Materials Design of Solid Electrolytes
"Computation-Accelerated Design of Materials and Interfaces for All-Solid-State Lithium-Ion Batteries", Joule, 2, 2016-2046 (2018)
► Electrochemical Stabilities of Solid Electrolytes
"Electrochemical Stability of Li10GeP2S12 and Li7La3Zr2O12 Solid Electrolytes", Advanced Energy Materials, 6, 1501590 (2016)
► Computational Design of Stable Coating for Solid-State Li-ion Batteries
"Solid-State Chemistries Stable with High-Energy Cathodes for Lithium-Ion Batteries", ACS Energy Letters, 4, 2444-2451 (2019); "Computation-Guided Discovery of Coating Materials to Stabilize the Interface between Lithium Garnet Solid Electrolyte and High-Energy Cathodes for All-Solid-State Lithium Batteries", Energy Storage Materials 41, 571-580 (2021); "Interfacial Atomistic Mechanisms of Lithium Metal Stripping and Plating in Solid-State Batteries", Advanced Materials 33, 2008081 (2021)
► Computational Study on Interface Stability of All-Solid-State Li-ion Batteries
"First Principles Study on Electrochemical and Chemical Stability of the Solid Electrolyte-Electrode Interfaces in All-Solid-State Li-ion Batteries", Journal of Materials Chemistry A, 4, 3253-3266 (2016) (Featured Front Cover)
Podcast
► Paper Chat - Concerted Migration: Origin of Fast Ion Conductors
"Origin of Fast Ion Diffusion in Super-Ionic Conductors", Nature Communications, 8, 15893 (2017)
► Paper Chat - Density of Atomistic States (DOAS) for Studying Ion Conductors
"Frustration in Super-Ionic Conductors Unraveled by the Density of Atomistic States", Angewandte Chemie Int. Ed. 62, e202215544 (2023)
► Paper Chat - Design Principles for Sodium Superionic Conductors
"Design principles for sodium superionic conductors", Nature Communications, 14, 7615 (2023)
Selected Invited Presentations
- Yifei Mo, “Crystal Structure of Fast Li-Ion Conductors: Insights from Computation Analysis”, Electrochemical Society (ECS) Meeting, Atlanta, GA (10/2019)
- Yifei Mo, “Solid Electrolyte Chemistry with Fast Ion Conduction and Good Electrochemical Stability: Insights from First Principles Computation”, Electrochemical Society (ECS) Meeting, Atlanta, GA (10/2019)
- Yifei Mo, “Design Principles for Solid Electrolyte–Electrode Interfaces in All-Solid-State Li-Ion Batteries: Insight from First-Principles Computation”, MRS Fall Meeting, Boston, MA (11/2018)
- Yifei Mo, “Computation Accelerated Design of Materials and Interfaces for All-Solid-State Li-ion Batteries”, Nature Conference on Materials Electrochemistry: Fundamentals & Applications, Shenzhen, China (01/2018)
- Yifei Mo, “Computation Accelerated Design of Materials and Interfaces for Solid-State Batteries”, Geophysical Laboratory, Carnegie Institution for Science, Washington, DC (07/2017) — Video