The 99th CSJ Annual Meeting

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Academic Program (AP)

Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Sat. Mar 16, 2019 9:00 AM - 12:20 PM D6 (336, Bldg. 3 [3F])

1D6-01～1D6-06　ISHIDA, Toyokazu
1D6-08～1D6-12　TACHIKAWA, Masanori
1D6-15　SATO, Hirofumi

AM

10:10 AM - 10:30 AM

[1D6-08] Predicting thermodynamic stability of multinary alloy nanoparticle

Oral B

○NAMBA, Yusuke; KOYAMA, Michihisa (GREEN, NIMS)

PC Setting Time : 10:00 - 10:10

Keywords:Multinary alloy nanoparticles、Thermodynamic stability、Density functional theory、Supervised learning、Monte Carlo simulation

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