WEKO3
Item
ML_direct_N2O_decomposition
https://aist.repo.nii.ac.jp/records/2003399
https://aist.repo.nii.ac.jp/records/20033996152c084-65de-4b61-92c8-5c3429bfa461
| Name / File | License | Actions |
|---|---|---|
20250609_N2O_dataset.xlsx (88 KB)
|
.png)
|
|
|
Descriptors_N2O.xlsx (293 KB)
|
|
|
scripts.zip (408 KB)
|
|
|
|
test.zip (333 KB)
|
|
|
|
20250609_Descriptor_represenations_N2O.xlsx (10 KB)
|
|
| Item type | Research Data v10(1) | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| PubDate | 2025-08-27 | |||||||||
| Data name | ||||||||||
| Title | ML_direct_N2O_decomposition | |||||||||
| Language | en | |||||||||
| Description of data | ||||||||||
| Description Type | Abstract | |||||||||
| Description | Data repository consisting of machine learning code written in Python (.py and .ipynb), experimental datasets (.xlsx), and a README.md file describing the code for proposing a multi-element heterogeneous catalyst effective for direct N2O decomposition. In addition, the code package test.zip was prepared to enable reproduction and hands-on experience of the catalyst discovery workflow on a Jupyter Notebook (grid_search_test_1cycle.ipynb) with only an Anaconda environment. |
|||||||||
| Language | en | |||||||||
| Description of data | ||||||||||
| Description Type | Other | |||||||||
| Description | Jan. 2026: The code package test.zip was prepared to enable reproduction and hands-on experience of the catalyst discovery workflow on a Jupyter Notebook (grid_search_test_1cycle.ipynb) with only an Anaconda environment. | |||||||||
| Language | en | |||||||||
| Description of data | ||||||||||
| Description Type | Other | |||||||||
| Description | Jan. 2026: To facilitate the reproduction of the catalyst-screening workflow, I compiled (i) the lists of elemental descriptor combinations selected at each iteration and (ii) the combinations of input representations used for PGM, Additive, and Support in each iteration. These data have been released as 20250609_Descriptor_representations_N2O.xlsx. | |||||||||
| Language | en | |||||||||
| Author (Creator) name |
Mine, Shinya
× Mine, Shinya （代表作成者）
ORCID
0000-0002-8339-0301
|
|||||||||
| Terms of Use | ||||||||||
| Rights Resource | https://creativecommons.org/licenses/by/4.0/deed.en | |||||||||
| Rights | Creative Commons Attribution 4.0 International | |||||||||
| Language | en | |||||||||
| Terms of Use | ||||||||||
| Rights | This project is licensed under the `CC BY 4.0` license. | |||||||||
| Language | en | |||||||||
| Keyword | ||||||||||
| Language | ja | |||||||||
| Subject Scheme | Other | |||||||||
| Subject | 機械学習 | |||||||||
| Keyword | ||||||||||
| Language | ja | |||||||||
| Subject Scheme | Other | |||||||||
| Subject | 触媒開発 | |||||||||
| Keyword | ||||||||||
| Language | ja | |||||||||
| Subject Scheme | Other | |||||||||
| Subject | N2O直接分解 | |||||||||
| Keyword | ||||||||||
| Language | en | |||||||||
| Subject Scheme | Other | |||||||||
| Subject | Machine learning | |||||||||
| Keyword | ||||||||||
| Language | en | |||||||||
| Subject Scheme | Other | |||||||||
| Subject | Development of catalysts | |||||||||
| Keyword | ||||||||||
| Language | en | |||||||||
| Subject Scheme | Other | |||||||||
| Subject | Direct N2O decomposition | |||||||||
| Publisher | ||||||||||
| Publisher | National Institute of Advanced Industrial Science and Technology (AIST) | |||||||||
| Language | en | |||||||||
| Date | ||||||||||
| Date | 2025-08-27 | |||||||||
| Date Type | Issued | |||||||||
| Date | ||||||||||
| Date | 2026-01-07 | |||||||||
| Date Type | Updated | |||||||||
| Date | ||||||||||
| Date | 2026-01-16 | |||||||||
| Date Type | Updated | |||||||||
| Language | ||||||||||
| Language | eng | |||||||||
| Resource Type | ||||||||||
| Resource Type Identifier | http://purl.org/coar/resource_type/c_ddb1 | |||||||||
| Resource Type | dataset | |||||||||
| Identifier | ||||||||||
| Identifier | https://doi.org/10.57765/2003399 | |||||||||
| Identifier Type | DOI | |||||||||
