Zobrazeno 1 - 10
of 51
pro vyhledávání: '"Tomoyuki Kinjo"'
Publikováno v:
Bulletin of the Chemical Society of Japan. 94:1563-1570
Molecular dynamics simulations are used to study the fracture mechanism of the joining interface of a polymer and metal oxide. A polyphenylene sulfide (PPS) layer is sandwiched between two plates o...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::4d033a288bd22b7e4f1114e4387c5b9d
https://doi.org/10.1246/bcsj.20200387
https://doi.org/10.1246/bcsj.20200387
Publikováno v:
Communications Physics, Vol 3, Iss 1, Pp 1-11 (2020)
Functional materials, especially those that largely differ from known materials, are not easily discoverable because both human experts and supervised machine learning need prior knowledge and datasets. An autonomous system can evaluate various prope
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4c4e3dee2990eef709e63f2db63211aa
http://link.springer.com/article/10.1038/s42005-020-0338-y
http://link.springer.com/article/10.1038/s42005-020-0338-y
Autor:
Yoshitake Suganuma, Hiroaki Yoneyama, Tomoyuki Kinjo, Kazuhiko Umemoto, Satoru Yamamoto, Takuya Mitsuoka
Publikováno v:
The Journal of Physical Chemistry B. 123:4434-4442
This study aims to develop a molecular dynamics (MD) simulation procedure to investigate the wettability of primer-treated Al2O3 surfaces by bisphenol A diglycidyl ether (BADGE) and to understand t...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::ca55fd67c349e9e3bb1483dd024c9ce6
https://doi.org/10.1021/acs.jpcb.9b00680
https://doi.org/10.1021/acs.jpcb.9b00680
Autor:
Tomoyuki Kinjo, Satoru Yamamoto
Publikováno v:
Multiscale Simulations for Electrochemical Devices ISBN: 9780429295454
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c89a72f6477bc4321f3de15e7d143081
https://doi.org/10.1201/9780429295454-6
https://doi.org/10.1201/9780429295454-6
Publikováno v:
Colloid and Polymer Science. 296:441-449
We investigate the structure of polyelectrolyte brushes to determine the effects of the charge fraction of the polymers, grafting density, chain length, and salt concentration. A hybrid coarse-grained model is employed, where a soft potential is appl
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c6679c3280cb07991b7a8a4a48856c48
https://doi.org/10.1007/s00396-017-4258-7
https://doi.org/10.1007/s00396-017-4258-7
Publikováno v:
The Journal of Physical Chemistry B. 121:9929-9935
We use molecular dynamics (MD) simulations to investigate the wettability of Al2O3 (0001) by organic molecules. Diffusion coefficients estimated for organic molecules are clearly correlated with the contact angles observed experimentally. The results
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::fe470e4e13f2b6ac594a91a3998ad473
https://doi.org/10.1021/acs.jpcb.7b07062
https://doi.org/10.1021/acs.jpcb.7b07062
We present a numerical scheme for simulating the dynamics of Brownian particles suspended in a fluid. The motion of the particles is tracked by the Langevin equation, whereas the host fluid flow is analyzed by using the lattice Boltzmann method. The
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f88900cf9868e6470ad52f57d456874e
http://arxiv.org/abs/1909.13412
http://arxiv.org/abs/1909.13412
Autor:
Hitoshi Washizu, Motoo Fukuda, Shintaro Itoh, Hedong Zhang, Tomoyuki Kinjo, Kenji Fukuzawa, Hiroaki Yoshida
Publikováno v:
Tribology International. 93:163-171
Using a coarse-grained model that accurately reproduces the structures and pressures of the parent all-atom simulations, we performed molecular dynamics simulations to gain insight into the high-speed shear behavior of nanometer-thick perfluoropolyet
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::5cf33ebc5334c7729c173f8d90080639
https://doi.org/10.1016/j.triboint.2015.09.002
https://doi.org/10.1016/j.triboint.2015.09.002
Publikováno v:
Journal of Chemical Physics; 6/7/2014, Vol. 140 Issue 21, p214701-1-214701-12, 12p, 1 Diagram, 4 Charts, 10 Graphs
Publikováno v:
The journal of physical chemistry. B. 121(42)
We use molecular dynamics (MD) simulations to investigate the wettability of Al
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::bc706b9cdd01c68d37c6035103df6102
https://pubmed.ncbi.nlm.nih.gov/28960991
https://pubmed.ncbi.nlm.nih.gov/28960991