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ACS Applied Materials & Interfaces
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May 16, 2022
Computational Design to Suppress Thermal Runaway of Li-Ion Batteries via Atomic Substitutions to Cathode Materials
Yuki Yoshimoto, Takahiro Toma, Kenta Hongo, et al.
Journal of Computer-Aided Molecular Design
|
March 11, 2017
Bayesian molecular design with a chemical language model
Hisaki Ikebata, Kenta Hongo, Tetsu Isomura, et al.
Physical Review Letters
|
March 16, 2007
Equation of state and Raman frequency of diamond from quantum Monte Carlo simulations
Ryo Maezono, A Ma, M D Towler, et al.
The Journal of Physical Chemistry. A
|
September 13, 2019
Method for the Calculation of the Hamaker Constants of Organic Materials by the Lifshitz Macroscopic Approach with Density Functional Theory
Hideyuki Takagishi, Takashi Masuda, Tatsuya Shimoda, et al.
Advanced Science (Weinheim, Baden-Wurttemberg, Germany)
|
September 12, 2023
Stiffer Bonding of Armchair Edge in Single-Layer Molybdenum Disulfide Nanoribbons
Chunmeng Liu, Kenta Hongo, Ryo Maezono, et al.
ACS Omega
|
October 4, 2021
Importance of Van der Waals Interactions in Hydrogen Adsorption on a Silicon-carbide Nanotube Revisited with vdW-DFT and Quantum Monte Carlo
Genki I Prayogo, Hyeondeok Shin, Anouar Benali, et al.
The Journal of Chemical Physics
|
October 10, 2009
Ab initio quantum Monte Carlo study of the positronic hydrogen cyanide molecule
Yukiumi Kita, Ryo Maezono, Masanori Tachikawa, et al.
Journal of Chemical Theory and Computation
|
November 19, 2015
Diffusion Monte Carlo Study of Para-Diiodobenzene Polymorphism Revisited
Kenta Hongo, Mark A Watson, Toshiaki Iitaka, et al.
The Journal of Chemical Physics
|
December 3, 2008
Quantum Monte Carlo study of porphyrin transition metal complexes
Jun Koseki, Ryo Maezono, Masanori Tachikawa, et al.
ACS Omega
|
March 29, 2021
Insights into the Mechanical and Electrical Properties of a Metal-Phosphorene Interface: An Ab Initio Study with a Wide Range of Metals
Abdul Ghaffar, Mohit D Ganeriwala, Kenta Hongo, et al.
Page
of 7
Search research articles
Search
Showing results (21-30 of 63) with videos related to
Sort By:
Page
of 7
ACS Applied Materials & Interfaces
|
May 16, 2022
Computational Design to Suppress Thermal Runaway of Li-Ion Batteries via Atomic Substitutions to Cathode Materials
Yuki Yoshimoto, Takahiro Toma, Kenta Hongo, et al.
Journal of Computer-Aided Molecular Design
|
March 11, 2017
Bayesian molecular design with a chemical language model
Hisaki Ikebata, Kenta Hongo, Tetsu Isomura, et al.
Physical Review Letters
|
March 16, 2007
Equation of state and Raman frequency of diamond from quantum Monte Carlo simulations
Ryo Maezono, A Ma, M D Towler, et al.
The Journal of Physical Chemistry. A
|
September 13, 2019
Method for the Calculation of the Hamaker Constants of Organic Materials by the Lifshitz Macroscopic Approach with Density Functional Theory
Hideyuki Takagishi, Takashi Masuda, Tatsuya Shimoda, et al.
Advanced Science (Weinheim, Baden-Wurttemberg, Germany)
|
September 12, 2023
Stiffer Bonding of Armchair Edge in Single-Layer Molybdenum Disulfide Nanoribbons
Chunmeng Liu, Kenta Hongo, Ryo Maezono, et al.
ACS Omega
|
October 4, 2021
Importance of Van der Waals Interactions in Hydrogen Adsorption on a Silicon-carbide Nanotube Revisited with vdW-DFT and Quantum Monte Carlo
Genki I Prayogo, Hyeondeok Shin, Anouar Benali, et al.
The Journal of Chemical Physics
|
October 10, 2009
Ab initio quantum Monte Carlo study of the positronic hydrogen cyanide molecule
Yukiumi Kita, Ryo Maezono, Masanori Tachikawa, et al.
Journal of Chemical Theory and Computation
|
November 19, 2015
Diffusion Monte Carlo Study of Para-Diiodobenzene Polymorphism Revisited
Kenta Hongo, Mark A Watson, Toshiaki Iitaka, et al.
The Journal of Chemical Physics
|
December 3, 2008
Quantum Monte Carlo study of porphyrin transition metal complexes
Jun Koseki, Ryo Maezono, Masanori Tachikawa, et al.
ACS Omega
|
March 29, 2021
Insights into the Mechanical and Electrical Properties of a Metal-Phosphorene Interface: An Ab Initio Study with a Wide Range of Metals
Abdul Ghaffar, Mohit D Ganeriwala, Kenta Hongo, et al.
Page
of 7