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Yoshiki Ishii
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Thermal Conductivity of Molten Alkali Metal Fluorides (LiF, NaF, KF) and their Mixtures
Y Ishii, K Sato, M Salanne, PA Madden, N Ohtori
Journal of Physical Chemistry B 118 (12), 3385-3391, 2014
602014
Elucidating Ionic Correlations Beyond Simple Charge Alternation in Molten MgCl2-KCl Mixtures
F Wu, S Roy, AS Ivanov, S Gill, M Topsakal, E Dooryhee, AMM Abeykoon, ...
Journal of Physical Chemistry Letters 10 (24), 7603-7610, 2019
562019
Transport Coefficients and the Stokes–Einstein Relation in Molten Alkali Halides with Polarisable Ion Model
Y Ishii, S Kasai, M Salanne, N Ohtori
Molecular Physics 113 (17-18), 2442-2450, 2015
462015
Molecular insights on confined water in the nanochannels of self-assembled ionic liquid crystal
Y Ishii, N Matubayasi, G Watanabe, T Kato, H Washizu
Science Advances 7 (31), eabf0669, 2021
442021
Explicit Expression for the Stokes-Einstein Relation for Pure Lennard-Jones Liquids
N Ohtori, Y Ishii
Physical Review E 91 (1), 012111, 2015
432015
Pressure Induced Structural Transformations in Amorphous MgSiO3 and CaSiO3
PS Salmon, GS Moody, Y Ishii, KJ Pizzey, A Polidori, M Salanne, ...
Journal of Non-Crystalline Solids: X 3, 100024, 2019
382019
Infrared Spectra and Hydrogen-Bond Configurations of Water Molecules at the Interface of Water-Insoluble Polymers under Humidified Conditions
Y Ikemoto, Y Harada, M Tanaka, S Nishimura, D Murakami, N Kurahashi, ...
Journal of Physical Chemistry B 126 (22), 4143-4151, 2022
332022
Breakdown of the Stokes-Einstein Relation in Pure Lennard-Jones Fluids: From Gas to Liquid via Supercritical States
N Ohtori, S Miyamoto, Y Ishii
Physical Review E 95, 052122, 2017
302017
A DFT-based aspherical ion model for sodium aluminosilicate glasses and melts
Y Ishii, M Salanne, T Charpentier, K Shiraki, K Kasahara, N Ohtori
Journal of Physical Chemistry C 120 (42), 24370-24381, 2016
292016
Transport Properties of Ionic Liquid and Sodium Salt Mixtures for Sodium-Ion Battery Electrolytes from Molecular Dynamics Simulation with a Self-Consistent Atomic Chargeá…
L Hakim, Y Ishii, K Matsumoto, R Hagiwara, K Ohara, Y Umebayashi, ...
Journal of Physical Chemistry B 124 (33), 7291-7305, 2020
262020
The Stokes-Einstein Relation for Simple Fluids: From Hard-Sphere to Lennard-Jones via WCA Potentials
N Ohtori, H Uchiyama, Y Ishii
Journal of Chemical Physics 149 (21), 214501, 2018
252018
Explicit Expressions of Self-Diffusion Coefficient, Shear Viscosity, and the Stokes-Einstein Relation for Binary Mixtures of Lennard-Jones Liquids
N Ohtori, Y Ishii
Journal of Chemical Physics 143 (16), 164514, 2015
242015
Self-Consistent Scheme Combining MD and Order-N DFT Methods: An Improved Set of Nonpolarizable Force Fields for Ionic Liquids
Y Ishii, N Matubayasi
Journal of Chemical Theory and Computation 16 (1), 651-665, 2020
182020
Spatially-Decomposed Free Energy of Solvation Based on the Endpoint Density-Functional Method
Y Ishii, N Yamamoto, N Matubayasi, BW Zhang, D Cui, RM Levy
Journal of Chemical Theory and Computation 15 (5), 2896-2912, 2019
162019
Molecular Insights into the Boundary Conditions in the Stokes-Einstein Relation
Y Ishii, N Ohtori
Physical Review E 93 (5), 050104, 2016
162016
Thermal Conductivity of Simple Liquids: Temperature and Packing-Fraction Dependence
N Ohtori, Y Ishii, Y Togawa, T Oono, K Takase
Physical Review E 89 (2), 022129, 2014
152014
The Stokes-Einstein relation for non-spherical molecular liquids
N Ohtori, Y Kondo, K Shintani, T Murakami, T Nobuta, Y Ishii
Chemistry Letters 49 (4), 379-382, 2020
142020
DFT-Based Polarizable Force Field for TiO2 and SiO2
D Corradini, Y Ishii, N Ohtori, M Salanne
Modelling and Simulation in Materials Science and Engineering 23 (7), 074005, 2015
142015
Thermal Conductivity of Simple Liquids: Origin of Temperature and Packing Fraction Dependences
Y Ishii, K Sato, M Salanne, PA Madden, N Ohtori
Journal of Chemical Physics 140 (11), 114502, 2014
142014
Preparation of dual-cross network polymers by the knitting method and evaluation of their mechanical properties
Y Kawai, J Park, Y Ishii, O Urakawa, S Murayama, R Ikura, M Osaki, ...
NPG Asia Materials 14 (1), 32, 2022
122022
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