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Mal Soon L | Catalysis Conferences 2019 | Chemical Engineering Conferences 2019 | Chemistry Conferences | Catalysis Virtual 2019 | Catalysis Webinars | Catalysis Online Conferences
Mal Soon L
Pacific Northwest National Laboratory, United States
Biography:
Mal-Soon Lee is a senior scientist at Pacific Northwest National Laboratory, USA. She has been working in the field of computational physics/chemistry with an emphasis on studying the phase behavior and reactivity at complex interfaces using a variety of statistical mechanical tools. Her areas of application include studies of catalysis, CO2 sequestration, nuclear waste disposal. She employs large-scale high-performance computing techniques such as ab initio molecular dynamics to understand materials’ properties and free energetics at high temperature/pressure. With statistical mechanical techniques, she calculates enthalpies/entropies of reaction, spectroscopic properties, which can be directly compared with experimental observations.
Title : Confinement effect of alcohols and water in MFI Zeolite from Ab Initio molecular dynamics simulations