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Kota Hanasaki

2 results in Authors: Kota Hanasaki

Theoretical and Computational Chemistry

Implementation of Real-Time TDDFT for Periodic Systems in the Open-Source PySCF Software Package

Kota Hanasaki, Zulfikhar Ali, Min Choi, Mauro Del Ben, Bryan Wong

Version 1 posted 07 December 2022

312

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Earth, Space, and Environmental Chemistry

Photo-induced degradation of PFASs: Excited-state mechanisms from real-time time-dependent density functional theory

Sharma Yamijala, Ravindra Shinde, Kota Hanasaki, Zulfikhar Ali, Bryan Wong

Version 1 posted 23 August 2021

272

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