# HeuslerDB_elecDOS_ver1.0

https://mdr.nims.go.jp/datasets/339efb21-ebf6-4687-a186-77874d6d5a6f

## File

- [PDOS_json_full_cubic_241229.tar.xz](https://mdr.nims.go.jp/filesets/9d4c0897-c93c-4bb6-9894-fa26066cedb7/download) ([Detail](https://mdr.nims.go.jp/filesets/9d4c0897-c93c-4bb6-9894-fa26066cedb7.md))
- [PDOS_json_full_tetra_241229.tar.xz](https://mdr.nims.go.jp/filesets/c2baa949-2b29-4e9b-ab38-c4d016c05347/download) ([Detail](https://mdr.nims.go.jp/filesets/c2baa949-2b29-4e9b-ab38-c4d016c05347.md))
- [PDOS_json_half_cubic_241229.tar.xz](https://mdr.nims.go.jp/filesets/5381b70e-f2de-47f2-b6a2-4548c860a2ff/download) ([Detail](https://mdr.nims.go.jp/filesets/5381b70e-f2de-47f2-b6a2-4548c860a2ff.md))
- [PDOS_json_half_tetra_241229.tar.xz](https://mdr.nims.go.jp/filesets/00c6ca6a-f2ed-472a-9ab6-2122999f6f38/download) ([Detail](https://mdr.nims.go.jp/filesets/00c6ca6a-f2ed-472a-9ab6-2122999f6f38.md))
- [PDOS_json_inverse_cubic_241229.tar.xz](https://mdr.nims.go.jp/filesets/40dfe7ab-9fce-42d0-b2ee-af93b7a5d69b/download) ([Detail](https://mdr.nims.go.jp/filesets/40dfe7ab-9fce-42d0-b2ee-af93b7a5d69b.md))
- [PDOS_json_inverse_tetra_241229.tar.xz](https://mdr.nims.go.jp/filesets/6573ac03-6760-44b9-bba7-8d0ba6957bee/download) ([Detail](https://mdr.nims.go.jp/filesets/6573ac03-6760-44b9-bba7-8d0ba6957bee.md))
- [pseudolist_Heuslerdb.txt](https://mdr.nims.go.jp/filesets/da3b8c69-bff0-49cb-9822-eac605b9fcf7/download) ([Detail](https://mdr.nims.go.jp/filesets/da3b8c69-bff0-49cb-9822-eac605b9fcf7.md))
- [README.md](https://mdr.nims.go.jp/filesets/1ddf22fb-a797-4fe4-ac4e-b95cf55e49f6/download) ([Detail](https://mdr.nims.go.jp/filesets/1ddf22fb-a797-4fe4-ac4e-b95cf55e49f6.md))

## Id

339efb21-ebf6-4687-a186-77874d6d5a6f

## Local identifier



## Visibility

open_to_public

## State

published

## Created at

2025-10-01T01:23:53.920235Z

## Updated at

2025-10-06T07:30:20.228668Z

## Published at

2025-10-06T07:21:47.687655Z

## Doi

https://doi.org/10.48505/nims.5794

## First published url

https://doi.org/10.1016/j.actamat.2025.121312

## Date published

2025-07-16

## Recorded date published

2025-9

## Resource type

dataset

## Manuscript type

na

## Collection



## Title

- title: HeuslerDB_elecDOS_ver1.0
  title_type: original
  lang: en

## Description

- description: "This repository contains the electronic density of states (DOS) computed
    using VASP for ternary Heusler alloys reported in https://www.sciencedirect.com/science/article/pii/S1359645425005981.
    The number of entries is 51,373. The DOS data is stored in a JSON format and can
    be easily loaded and processed using Python, as detailed below.\r\n\r\nThe data
    is organized by compound type (full, inverse, half) and crystal structure (cubic,
    tetragonal).\r\n\r\n- PDOS_json_full_cubic_241229.tar.xz: Full Heusler compounds
    in cubic structure\r\n- PDOS_json_full_tetra_241229.tar.xz: Full Heusler compounds
    in tetragonal structure\r\n- PDOS_json_inverse_cubic_241229.tar.xz: Inverse Heusler
    compounds in cubic structure\r\n- PDOS_json_inverse_tetra_241229.tar.xz: Inverse
    Heusler compounds in tetragonal structure\r\n- PDOS_json_half_cubic_241229.tar.xz:
    Half Heusler compounds in cubic structure\r\n- PDOS_json_half_tetra_241229.tar.xz:
    Half Heusler compounds in tetragonal structure"
  description_type: abstract
  lang: en

## Creator

- name: Terumasa Tadano
  role: author
  orcid: https://orcid.org/0000-0002-8132-2161
  organization: National Institute for Materials Science
  department: Spin Theory Group, Research Center for Magnetic and Spintronic Materials
  ror: https://ror.org/026v1ze26

## Contact agent



## Publisher



## Managing organization



## Keyword

- subject: Heusler alloys
  schema: not_defined

## Rights

- identifier: https://creativecommons.org/licenses/by/4.0/

## Other identifier(s)



## Data origin

- data_origin_type: other

## Embargo



## Journal



## Conference



## Related item



## Funding



## Instrument



## Instrument operator



## Instrument managing organization



## Measurement method



## Specimen



## Chemical composition



## Structure for specimen



## Structural feature for specimen



## Specific property for specimen



## Process for specimen treatment



## Computational method



## Energy level/transition state



## Software



## Custom property



## Fileset

- id: 9d4c0897-c93c-4bb6-9894-fa26066cedb7
  filename: PDOS_json_full_cubic_241229.tar.xz
  content_type: application/x-xz
  size: 616875440
  md5: 6fe929316c50f883a82f7a1374cd95a1
- id: c2baa949-2b29-4e9b-ab38-c4d016c05347
  filename: PDOS_json_full_tetra_241229.tar.xz
  content_type: application/x-xz
  size: 602336816
  md5: a3aedd0021605ada1304bf32830cc8b7
- id: 5381b70e-f2de-47f2-b6a2-4548c860a2ff
  filename: PDOS_json_half_cubic_241229.tar.xz
  content_type: application/x-xz
  size: 580282940
  md5: 850f69e222a5db39700e7e8e0838e2d2
- id: 00c6ca6a-f2ed-472a-9ab6-2122999f6f38
  filename: PDOS_json_half_tetra_241229.tar.xz
  content_type: application/x-xz
  size: 489900752
  md5: 7308c130c95568faa71fc359d4daecab
- id: 40dfe7ab-9fce-42d0-b2ee-af93b7a5d69b
  filename: PDOS_json_inverse_cubic_241229.tar.xz
  content_type: application/x-xz
  size: 704161344
  md5: c9d84246aa8c90dd7dd5948ad3f09920
- id: 6573ac03-6760-44b9-bba7-8d0ba6957bee
  filename: PDOS_json_inverse_tetra_241229.tar.xz
  content_type: application/x-xz
  size: 755312808
  md5: 0a0bfb9ac320f60d97b6bb78306e7d8c
- id: da3b8c69-bff0-49cb-9822-eac605b9fcf7
  filename: pseudolist_Heuslerdb.txt
  content_type: text/plain
  size: 350
  md5: c1bb9cd8e1b7d3d28952349e012d8b9a
- id: 1ddf22fb-a797-4fe4-ac4e-b95cf55e49f6
  filename: README.md
  content_type: text/markdown
  size: 4019
  md5: cadce0a0f00e3829d6231a3093b258f7

## Thumbnail