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256 records found. Displaying records 1 to 10.

Movie1.mp4
Free Analysis and Visualization Programs for Electrochemical Impedance Spectroscopy Coded in Python
Journal article
Creator
ORCID SAMURAI ;
SUZUKI, Tohru S. (author) (Search by this author)
Keyword
model fitting, free software, electrochemical impedance, data visualization
Date published
2021-03-05
Updated at
2024-01-05 22:11:18 +0900

2603.14155v2.pdf
The Python simulations of chemistry framework: 10 years of an open-source quantum chemistry project
Journal article
Creator
Qiming Sun (author) (Search by this author)
ORCID ;
Matthew R. Hermes (author) (Search by this author)
ORCID ;
Xiaojie Wu (author) (Search by this author)
ORCID ;
Huanchen Zhai (author) (Search by this author)
ORCID ;
Xing Zhang (author) (Search by this author)
ORCID ;
Abdelrahman M. Ahmed (author) (Search by this author)
ORCID ;
Juan José Aucar (author) (Search by this author)
ORCID ;
Oliver J. Backhouse (author) (Search by this author)
;
Samragni Banerjee (author) (Search by this author)
ORCID ;
Peng Bao (author) (Search by this author)
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Nikolay A. Bogdanov (author) (Search by this author)
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Kyle Bystrom (author) (Search by this author)
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Frédéric Chapoton (author) (Search by this author)
ORCID ;
Ning-Yuan Chen (author) (Search by this author)
ORCID ;
Ivan Yu. Chernyshov (author) (Search by this author)
;
Helen S. Clifford (author) (Search by this author)
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Sander Cohen-Janes (author) (Search by this author)
ORCID ;
Zhi-Hao Cui (author) (Search by this author)
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Yann D. Damour (author) (Search by this author)
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Nike Dattani (author) (Search by this author)
;
Linus Bjarne Dittmer (author) (Search by this author)
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Sebastian Ehlert (author) (Search by this author)
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Janus Juul Eriksen (author) (Search by this author)
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Francesco A. Evangelista (author) (Search by this author)
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Simon A. Ewing (author) (Search by this author)
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Ardavan Farahvash (author) (Search by this author)
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Kevin Focke (author) (Search by this author)
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Yang Gao (author) (Search by this author)
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Kevin E. Gasperich (author) (Search by this author)
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Nathan Gillispie (author) (Search by this author)
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Jonas Greiner (author) (Search by this author)
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Matthew R. Hennefarth (author) (Search by this author)
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Jan Hermann (author) (Search by this author)
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Christopher Hillenbrand (author) (Search by this author)
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Joonatan Huhtasalo (author) (Search by this author)
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Basil Ibrahim (author) (Search by this author)
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Bhavnesh Jangid (author) (Search by this author)
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Alireza Nejati Javaremi (author) (Search by this author)
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Andrew J. Jenkins (author) (Search by this author)
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Yu Jin (author) (Search by this author)
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Daniel S. King (author) (Search by this author)
;
Derk Pieter Kooi (author) (Search by this author)
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Jo S. Kurian (author) (Search by this author)
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Henrik R. Larsson (author) (Search by this author)
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Bryan Tak Gwong Lau (author) (Search by this author)
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Seunghoon Lee (author) (Search by this author)
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Susi Lehtola (author) (Search by this author)
ORCID ;
Chenghan Li (author) (Search by this author)
ORCID ;
Hao Li (author) (Search by this author)
;
Jiachen Li (author) (Search by this author)
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Rui Li (author) (Search by this author)
ORCID ;
Shuhang Li (author) (Search by this author)
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Aleksandr O. Lykhin (author) (Search by this author)
ORCID ;
Ankit Mahajan (author) (Search by this author)
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Nastasia Mauger (author) (Search by this author)
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Pablo del Mazo-Sevillano (author) (Search by this author)
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Jonathan Moussa (author) (Search by this author)
ORCID ; ORCID SAMURAI ;
Verena A. Neufeld (author) (Search by this author)
ORCID ;
Linqing Peng (author) (Search by this author)
ORCID ;
Hung Q. Pham (author) (Search by this author)
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Peter Pinski (author) (Search by this author)
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Pavel Pokhilko (author) (Search by this author)
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Zhichen Pu (author) (Search by this author)
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Yubing Qian (author) (Search by this author)
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Stephen Jon Quiton (author) (Search by this author)
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Wanja T. Schulze (author) (Search by this author)
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Thais R. Scott (author) (Search by this author)
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Aniruddha Seal (author) (Search by this author)
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James D. Serna (author) (Search by this author)
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James E. T. Smith (author) (Search by this author)
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Kori E. Smyser (author) (Search by this author)
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Terrence Stahl (author) (Search by this author)
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Chong Sun (author) (Search by this author)
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Kevin J. Sung (author) (Search by this author)
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Egor Trushin (author) (Search by this author)
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Shiv Upadhyay (author) (Search by this author)
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Ethan A. Vo (author) (Search by this author)
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Thijs Vogels (author) (Search by this author)
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Shirong Wang (author) (Search by this author)
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Tai Wang (author) (Search by this author)
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Xiao Wang (author) (Search by this author)
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Xubo Wang (author) (Search by this author)
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Yuanheng Wang (author) (Search by this author)
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Mark Williamson (author) (Search by this author)
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Junjie Yang (author) (Search by this author)
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Hong-Zhou Ye (author) (Search by this author)
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Chia-Nan Yeh (author) (Search by this author)
;
Haiyang Yu (author) (Search by this author)
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Jincheng Yu (author) (Search by this author)
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Victor Wen-zhe Yu (author) (Search by this author)
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Chaoqun Zhang (author) (Search by this author)
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Dayou Zhang (author) (Search by this author)
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Yichi Zhang (author) (Search by this author)
;
Zijun Zhao (author) (Search by this author)
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Zehao Zhou (author) (Search by this author)
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Andrew J. Zhu (author) (Search by this author)
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Tianyu Zhu (author) (Search by this author)
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Timothy C. Berkelbach (author) (Search by this author)
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Laura Gagliardi (author) (Search by this author)
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Sandeep Sharma (author) (Search by this author)
ORCID ;
Alexander Yu. Sokolov (author) (Search by this author)
ORCID ;
Garnet Kin-Lic Chan (author) (Search by this author)
ORCID
Keyword
qunatum chemistry
Date published
2026-09-14
Updated at
2026-09-11 11:25:23 +0900

Enhancing thermoelectric efficiency of GeTe through process improvement via active learning assisted by Bayesian optimisation.pdf
Enhancing thermoelectric efficiency of GeTe through process improvement via active learning assisted by Bayesian optimisation
Journal article
Creator
Florent Pawula (author) (Search by this author)
ORCID ;
Mathias Hamitouche (author) (Search by this author)
;
Linda Abbassi (author) (Search by this author)
;
Agathe Bajan (author) (Search by this author)
;
Cédric Bourgès (author) (Search by this author)
;
Takao Mori (author) (Search by this author)
ORCID SAMURAI ;
Jean-François Halet (author) (Search by this author)
;
David Berthebaud (author) (Search by this author)
;
Guillaume Lambard (author) (Search by this author)
ORCID SAMURAI
Keyword
Material process, bayesian optimisation, active learning, chalcogenides, thermoelectrics
Date published
2025-12-31
Updated at
2025-12-10 08:30:23 +0900

Estimation the S-N Curve by Machine Learning Random Forest Method_Mater. Trans. 65(2024)428-433.pdf
Estimating the S-N Curve by Machine Learning Random Forest Method
Journal article
Creator
Nobuo Nagashima (author) (Search by this author)
ORCID SAMURAI ;
Masao Hayakawa (author) (Search by this author)
ORCID SAMURAI ;
Hiroyuki Masuda (author) (Search by this author)
ORCID SAMURAI ;
Kotobu Nagai (author) (Search by this author)
National Institute for Materials Science
Keyword
fatigue, high-cycle fatigue, data-sheet, machine learning, random forest method
Date published
2024-04-01
Updated at
2024-12-27 16:30:58 +0900

Network-level Analysis of Damage in Amine-crosslinked Epoxy Resins Degraded by Acid.pdf
Network-level Analysis of Damage in Amine-crosslinked Diglycidyl Ether Resins Degraded by Acid
Journal article
Creator
Jonathon Tanks (author) (Search by this author)
ORCID SAMURAI ;
Yoshihiko Arao (author) (Search by this author)
;
Masatoshi Kubouchi (author) (Search by this author)
Keyword
Epoxy networks, Acid degradation, Amine crosslinker
Date published
2022-09-11
Updated at
2024-01-05 22:12:38 +0900

esi_clean.pdf
Multiobjective Solid Electrolyte Design of Tetragonal and Cubic Inverse-Perovskites for All-Solid-State Lithium-Ion Batteries by High-Throughput Density Functional Theory Calculations and AI-Driven Methods
Journal article
Creator
JALEM Randy (author) (Search by this author)
Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group, National Institute for Materials Science
ORCID SAMURAI ;
TATEYAMA Yoshitaka (author) (Search by this author)
Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group, National Institute for Materials Science
ORCID SAMURAI ;
TAKADA Kazunori (author) (Search by this author)
Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Solid-State Battery Group, National Institute for Materials Science
ORCID SAMURAI ;
JANG Seonghoon (author) (Search by this author)
Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group, National Institute for Materials Science
Keyword
all solid state batteries, solid electrolytes, density functional theory, materials informatics, machine learning, novel materials search
Date published
2023-09-07
Updated at
2024-08-28 08:30:15 +0900

biosensors-13-00152.pdf
Measurement of Volatile Fatty Acids in Silage through Odors with Nanomechanical Sensors
Journal article
Creator
Kosuke Minami (author) (Search by this author)
ORCID SAMURAI ;
Hisami Kobayashi (author) (Search by this author)
;
Masaaki Matoba (author) (Search by this author)
National Institute for Materials Science
;
Yuko Kamiya (author) (Search by this author)
;
Subrata Maji (author) (Search by this author)
National Institute for Materials Science
;
Takahiro Nemoto (author) (Search by this author)
National Institute for Materials Science
;
Masanori Tohno (author) (Search by this author)
;
Ryoh Nakakubo (author) (Search by this author)
;
Genki Yoshikawa (author) (Search by this author)
ORCID SAMURAI
Keyword
nanomechanical sensors, olfactory sensors
Date published
2023-01-18
Updated at
2024-01-05 22:11:47 +0900

monte_carlo_tree_search_for_materials_design_and_discovery.pdf
Monte Carlo tree search for materials design and discovery
Journal article
Creator
Ju, Shenghong (author) (Search by this author)
; ORCID SAMURAI ;
Shiomi, Junichiro (author) (Search by this author)
; ORCID SAMURAI
Keyword
Materials design and discovery
Date published
2019-06-20
Updated at
2024-01-05 22:11:17 +0900

shrine20230330-1595-1im5f61.pdf
Unveiling the principle descriptor for predicting the electron inelastic mean free path based on a machine learning framework
Journal article
Creator
Xun Liu (author) (Search by this author)
National Institute for Materials Science
;
Zhufeng Hou (author) (Search by this author)
;
Dabao Lu (author) (Search by this author)
;
Bo Da (author) (Search by this author)
ORCID SAMURAI ;
Hideki Yoshikawa (author) (Search by this author)
ORCID SAMURAI ;
Shigeo Tanuma (author) (Search by this author)
ORCID SAMURAI ;
Yang Sun (author) (Search by this author)
;
Zejun Ding (author) (Search by this author)
Keyword
machine learning, inelastic mean free path, LASSO
Date published
2019-12-31
Updated at
2024-09-05 16:30:30 +0900

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