Zobrazeno 1 - 5
of 5
pro vyhledávání: '"Patrick A. Bonnaud"'
Autor:
Ryusuke Futamura, Taku Iiyama, Takahiro Ueda, Patrick A. Bonnaud, François-Xavier Coudert, Ayumi Furuse, Hideki Tanaka, Roland J. -M. Pellenq, Katsumi Kaneko
Publikováno v:
Nature Communications, Vol 15, Iss 1, Pp 1-12 (2024)
Abstract Graphene oxide (GO) is the one of the most promising family of materials as atomically thin membranes for water-related molecular separation technologies due to its amphipathic nature and layered structure. Here, we show important aspects of
Externí odkaz:
https://doaj.org/article/13f56d2190d948ddac35a2589877ae27
Publikováno v:
The Journal of Physical Chemistry B. 126:4899-4913
Shear-thickening fluids that absorb the impact energy of high-velocity projectiles are of great interest for aerospace and body-armor applications. In such a frame, we investigate transient states of neat and aqueous polyelectrolytes (PE) having low
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::83c00b30531141d70fc8d45705f29ac5
https://doi.org/10.1021/acs.jpcb.2c01448
https://doi.org/10.1021/acs.jpcb.2c01448
Publikováno v:
Chemical Physics Letters. 816:140387
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2941a3498f97cd4eef7c4083c4992529
https://doi.org/10.1016/j.cplett.2023.140387
https://doi.org/10.1016/j.cplett.2023.140387
Publikováno v:
Addi. Archivo Digital para la Docencia y la Investigación
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[EN] The C-S-H gel is an elusive material. Its variable composition and disordered nature complicate a complete characterization of its atomic structure, and the elaboration of models is key to understanding it. This work aims to review those propose
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3a463aab8f6c4f24cc3676e5d480e027
https://doi.org/10.1016/j.cemconres.2022.106784
https://doi.org/10.1016/j.cemconres.2022.106784
Autor:
Akira Miyamoto, Patrick Alain Bonnaud, Ryuji Miura, Ai Suzuki, Naoto Miyamoto, Nozomu Hatakeyama
Publikováno v:
ECS Meeting Abstracts. :3181-3181
Our previous research work using different computational methods for the design of phosphor/luminescence materials, show our multiscale, multiphysics computational chemistry methods based on the ultra-accelerated quantum chemical molecular dynamics(U
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::5bdc9c053d2f91acc86efdf93993c0e5
https://doi.org/10.1149/ma2016-02/42/3181
https://doi.org/10.1149/ma2016-02/42/3181