نتائج البحث - "Jinnouchi, Ryosuke"

1

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Machine learning surrogate models for particle insertions and element substitutions

المؤلفون: Jinnouchi, Ryosuke

مصطلحات موضوعية: Physics - Chemical Physics

URL الوصول: http://arxiv.org/abs/2409.19188

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2

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Absolute standard hydrogen electrode potential and redox potentials of atoms and molecules: machine learning aided first principles calculations

المؤلفون: Jinnouchi, Ryosuke, Karsai, Ferenc, Kresse, Georg

مصطلحات موضوعية: Physics - Chemical Physics

URL الوصول: http://arxiv.org/abs/2409.11000

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3

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Comparing machine learning potentials for water: Kernel-based regression and Behler-Parrinello neural networks

المؤلفون: de Hijes, Pablo Montero, Dellago, Christoph, Jinnouchi, Ryosuke, Schmiedmayer, Bernhard, Kresse, Georg

مصطلحات موضوعية: Condensed Matter - Soft Condensed Matter

URL الوصول: http://arxiv.org/abs/2312.15213

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4

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Machine Learning-Aided First-Principles Calculations of Redox Potentials

المؤلفون: Jinnouchi, Ryosuke, Karsai, Ferenc, Kresse, Georg

مصطلحات موضوعية: Physics - Chemical Physics

URL الوصول: http://arxiv.org/abs/2309.13217

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5

Academic Journal

Density isobar of water and melting temperature of ice: Assessing common density functionals.

المؤلفون: Montero de Hijes, Pablo, Dellago, Christoph, Jinnouchi, Ryosuke, Kresse, Georg

المصدر: Journal of Chemical Physics; 10/7/2024, Vol. 161 Issue 13, p1-8, 8p

مصطلحات موضوعية: DENSITY functionals, DENSITY functional theory, MELTWATER, WATER temperature, MACHINE learning

6

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Thermal transport and phase transitions of zirconia by on-the-fly machine-learned interatomic potentials

المؤلفون: Verdi, Carla, Karsai, Ferenc, Liu, Peitao, Jinnouchi, Ryosuke, Kresse, Georg

المصدر: npj Comput. Mater. 7, 156 (2021)

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/2109.15002

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7

Academic Journal

The Melamine-Driven Solvation Effect Promotes Oxygen Reduction on a Platinum Catalyst: Machine Learning-Aided Free Energy Calculations

المؤلفون: Jinnouchi, Ryosuke, Minami, Saori

المصدر: The Journal of Physical Chemistry Letters ; volume 16, issue 1, page 265-273 ; ISSN 1948-7185 1948-7185

الاتاحة: https://doi.org/10.1021/acs.jpclett.4c03437
https://pubs.acs.org/doi/pdf/10.1021/acs.jpclett.4c03437

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8

Academic Journal

Machine learning-aided first-principles calculations of redox potentials

المؤلفون: Jinnouchi, Ryosuke, Karsai, Ferenc, Kresse, Georg

المصدر: npj Computational Materials ; volume 10, issue 1 ; ISSN 2057-3960

الاتاحة: http://dx.doi.org/10.1038/s41524-024-01295-6
https://www.nature.com/articles/s41524-024-01295-6.pdf
https://www.nature.com/articles/s41524-024-01295-6

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9

Academic Journal

Effects of solvent composition on agglomerate structure in catalyst ink for polymer electrolyte fuel cells

المؤلفون: Yoshino, Shuhei, Harada, Masashi, Hasegawa, Naoki, Jinnouchi, Ryosuke

المصدر: Colloids and Surfaces A: Physicochemical and Engineering Aspects ; volume 691, page 133847 ; ISSN 0927-7757

الاتاحة: http://dx.doi.org/10.1016/j.colsurfa.2024.133847
https://api.elsevier.com/content/article/PII:S0927775724007088?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0927775724007088?httpAccept=text/plain

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10

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Long-range order imposed by short-range interactions in methylammonium lead iodide: Comparing point-dipole models to machine-learning force fields

المؤلفون: Lahnsteiner, Jonathan, Jinnouchi, Ryosuke, Bokdam, Menno

المصدر: Phys. Rev. B 100, 094106 (2019)

مصطلحات موضوعية: Condensed Matter - Materials Science, Condensed Matter - Statistical Mechanics

URL الوصول: http://arxiv.org/abs/1905.12540

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11

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On-the-fly machine learning force field generation: Application to melting points

المؤلفون: Jinnouchi, Ryosuke, Karsai, Ferenc, Kresse, Georg

المصدر: Phys. Rev. B 100, 014105 (2019)

مصطلحات موضوعية: Condensed Matter - Materials Science, Physics - Computational Physics

URL الوصول: http://arxiv.org/abs/1904.12961

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12

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Phase transitions of hybrid perovskites simulated by machine-learning force fields trained on-the-fly with Bayesian inference

المؤلفون: Jinnouchi, Ryosuke, Lahnsteiner, Jonathan, Karsai, Ferenc, Kresse, Georg, Bokdam, Menno

المصدر: Phys. Rev. Lett. 122, 225701 (2019)

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/1903.09613

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13

Academic Journal

Comparing machine learning potentials for water: Kernel-based regression and Behler–Parrinello neural networks.

المؤلفون: Montero de Hijes, Pablo, Dellago, Christoph, Jinnouchi, Ryosuke, Schmiedmayer, Bernhard, Kresse, Georg

المصدر: Journal of Chemical Physics; 3/21/2024, Vol. 160 Issue 11, p1-12, 12p

14

2023 Roadmap on molecular modelling of electrochemical energy materials

المصدر: Journal of Physics. 5(4)

مصطلحات موضوعية: electrochemical interfaces, density-functional theory, molecular dynamics simulation, electrochemical energy storage, machine learning, electrocatalysis, Kemi med inriktning mot materialkemi, Chemistry with specialization in Materials Chemistry

وصف الملف: electronic

URL الوصول: https://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-518005
https://doi.org/10.1088/2515-7655/acfe9b
https://uu.diva-portal.org/smash/get/diva2:1819803/FULLTEXT01.pdf

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15

Academic Journal

Absolute standard hydrogen electrode potential and redox potentials of atoms and molecules: machine learning aided first principles calculations.

المؤلفون: Jinnouchi, Ryosuke, Karsai, Ferenc, Kresse, Georg

المصدر: Chemical Science; 2/7/2025, Vol. 16 Issue 5, p2335-2343, 9p

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16

Academic Journal

The Melamine-Driven Solvation Effect Promotes Oxygen Reduction on a Platinum Catalyst: Machine Learning-Aided Free Energy Calculations.

المؤلفون: Jinnouchi, Ryosuke, Minami, Saori

المصدر: Journal of Physical Chemistry Letters; 1/9/2025, Vol. 16 Issue 1, p265-273, 9p

17

Academic Journal

Author Correction: The role of oxygen-permeable ionomer for polymer electrolyte fuel cells

المؤلفون: Jinnouchi, Ryosuke, Kudo, Kenji, Kodama, Kensaku, Kitano, Naoki, Suzuki, Takahisa, Minami, Saori, Shinozaki, Kazuma, Hasegawa, Naoki, Shinohara, Akihiro

المصدر: Nature Communications ; volume 14, issue 1 ; ISSN 2041-1723

الاتاحة: https://doi.org/10.1038/s41467-023-40630-1
https://www.nature.com/articles/s41467-023-40630-1.pdf
https://www.nature.com/articles/s41467-023-40630-1

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18

Academic Journal

Accelerating anhydrous proton conduction via anion rotation and hydrogen bond recombination: a machine-learning molecular dynamics

المؤلفون: Minami, Saori, Jinnouchi, Ryosuke

المصدر: Journal of Materials Chemistry A ; volume 11, issue 30, page 16104-16114 ; ISSN 2050-7488 2050-7496

الاتاحة: http://dx.doi.org/10.1039/d3ta03164k
http://pubs.rsc.org/en/content/articlepdf/2023/TA/D3TA03164K

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19

Academic Journal

Translating insights from experimental analyses with single-crystal electrodes to practically-applicable material development strategies for controlling the Pt/ionomer interface in polymer electrolyte fuel cells

المؤلفون: Kodama, Kensaku, Suzuki, Takahisa, Shinozaki, Kazuma, Jinnouchi, Ryosuke

المصدر: Journal of Physics: Energy ; volume 5, issue 1, page 014018 ; ISSN 2515-7655

الاتاحة: http://dx.doi.org/10.1088/2515-7655/acb290
https://iopscience.iop.org/article/10.1088/2515-7655/acb290
https://iopscience.iop.org/article/10.1088/2515-7655/acb290/pdf

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20

Academic Journal

Grand-Canonical First Principles-Based Calculations of Electrochemical Reactions.

المؤلفون: Jinnouchi, Ryosuke

المصدر: Journal of The Electrochemical Society; Sep2024, Vol. 171 Issue 9, p1-7, 7p

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