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Pressure-assisted decomposition of tricresyl phosphate on amorphous FeO using hybrid quantum-classical simulations.
Sota Hayashi
Naoki Uemura
Masayuki Uranagase
Shuji Ogata
Published in:
J. Comput. Chem. (2023)
Keyphrases
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quantum computation
quantum mechanics
hybrid approaches
thin film
numerical simulations
image decomposition
decomposition method
simulation environment
quantum computing
database
mathematical analysis
classical methods
simulation model
relational databases
multi agent
feature selection
machine learning