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Recent & Upcoming Talks
2023
An automated multi-scale NMR framework helps understand solvent exchange dynamics in multivalent batteries
Nov 27, 2023 11:15 AM — 11:30 AM
Boston, MA
Guiding maps of solvents for lithium-sulfur batteries via a computational data-driven approach (Poster)
Nov 16, 2023 5:00 PM — 6:30 PM
Lemont, IL
Abstract
2022
Data-driven prediction of structure and dynamic features of li-s electrolytes with an automated multi-scale computational infrastructure
Dec 2, 2022 3:45 PM — 4:00 PM
Boston, MA
Towards accurate predictions of NMR chemical shifts in liquid solutions
Aug 23, 2022 4:15 PM — 4:35 PM
Chicago, IL
Abstract
Data‐driven investigation of solvents for lithium‐sulfur battery liquid electrolytes
Aug 21, 2022 3:10 PM — 3:25 PM
Chicago, IL
Abstract
MISPR A novel framework for high‐throughput multi‐scale modelling of complex liquid solutions (Poster)
Jul 20, 2022 2:00 PM — 4:00 PM
Delavan, WI
Tailoring atomistic interactions in Li‐S battery via a computational multi‐scale data‐driven approach
Jun 2, 2022 3:30 PM — 3:40 PM
Vancouver, BC
Abstract
Towards next generation batteries via high‐throughput modelling of electrolytes
Feb 1, 2022 12:00 PM — 1:00 PM
Stony Brook, NY
Event
2021
Tailoring atomistic interactions in Li‐S battery via a computational multi‐scale data‐driven approach
Oct 21, 2021 12:00 PM — 1:00 PM
Stony Brook, NY
Abstract
Designing optimal electrolytes and interfaces in Li‐S batteries (Invited)
May 30, 2021 9:00 AM — Jun 3, 2021 9:00 AM
Virtual
Abstract
A multi‐scale infrastructure for automating materials science computations (Invited)
May 30, 2021 9:00 AM — Jun 3, 2021 9:00 AM
Virtual
Abstract
Effects of functionalized cathode and electrolyte composition on structure and dissolution of polysulfide species in Li‐S batteries
Apr 17, 2021 3:30 PM — Apr 23, 2021 3:40 PM
Virtual
2020
Tailoring atomistic interactions in Li‐S battery via a computational multi‐scale‐data‐driven approach
Nov 27, 2020 3:30 PM — Dec 4, 2020 3:40 PM
Virtual
A high‐throughput multi‐scale infrastructure for automating materials science computations
Nov 27, 2020 3:30 PM — Dec 4, 2020 3:40 PM
Virtual
2019
Understanding formation of nitrogen heterocycles during catalytic hydrothermal liquefaction
Nov 11, 2019 12:30 PM — Aug 23, 2019 12:50 PM
Orlando, FL
Abstract
2017
Understanding the source of undesired nitrogen heterocycles in biofuel made by hydrothermal liquefaction of micro‐algae (Poster)
Jun 28, 2017 12:00 PM — 5:00 PM
Worcester, MA
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