Special quasi-random structures for the 6-component high entropy alloys

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{
  "revision": 1, 
  "id": "69", 
  "created": "2020-05-12T13:52:24.102650+00:00", 
  "metadata": {
    "doi": "10.24435/materialscloud:2018.0019/v1", 
    "status": "published", 
    "title": "Special quasi-random structures for the 6-component high entropy alloys", 
    "mcid": "2018.0019/v1", 
    "license_addendum": "", 
    "_files": [
      {
        "description": "The file contains the special quasi-random structures (SQSs) used in our work.", 
        "key": "SQSs_fcc6_hcp6.zip", 
        "size": 14156, 
        "checksum": "md5:37323d0b1bd092a921c436d3c659729e"
      }
    ], 
    "owner": 18, 
    "_oai": {
      "id": "oai:materialscloud.org:69"
    }, 
    "keywords": [
      "special quasi-random structures (SQSs)", 
      "high entropy alloys", 
      "random alloys", 
      "misfit volumes"
    ], 
    "conceptrecid": "68", 
    "is_last": true, 
    "references": [
      {
        "type": "Journal reference", 
        "doi": "10.1038/s41524-019-0151-x", 
        "url": "https://www.nature.com/articles/s41524-019-0151-x", 
        "comment": "", 
        "citation": "B. Yin, W. Curtin, npj Computational Materials 5, 14 (2019)"
      }
    ], 
    "publication_date": "Dec 03, 2018, 00:00:00", 
    "license": "Creative Commons Attribution 4.0 International", 
    "id": "69", 
    "description": "We propose a general method to calculate the average misfit volumes of atoms in any random alloy via DFT calculations. The method is validated with an example of a 6-component equi-composition high entropy alloy. The special quasi-random structures (SQSs) used in our work are reported here.", 
    "version": 1, 
    "contributors": [
      {
        "email": "binglun.yin@epfl.ch", 
        "affiliations": [
          "Laboratory for Multiscale Mechanics Modeling (LAMMM) and National Centre for Computational Design and Discovery of Novel Materials (NCCR MARVEL), Ecole Polytechnique Federale de Lausanne, 1015 Lausanne, Switzerland"
        ], 
        "familyname": "Yin", 
        "givennames": "Binglun"
      }, 
      {
        "affiliations": [
          "Laboratory for Multiscale Mechanics Modeling (LAMMM) and National Centre for Computational Design and Discovery of Novel Materials (NCCR MARVEL), Ecole Polytechnique Federale de Lausanne, 1015 Lausanne, Switzerland"
        ], 
        "familyname": "Curtin", 
        "givennames": "William"
      }
    ], 
    "edited_by": 98
  }, 
  "updated": "2018-12-03T00:00:00+00:00"
}