Hadoken!!!

hadokenmaterials.io (BETA)

The High Throughput Machine Learning Materials Design Platform

 

Gap Type - Space Group - Deep Learning

Machine Learning Home

Use this model created via deep learning for fast and accurate predictions of a material's gap type using stoichiometry and space group.

Load example values into the form.

Try it Yourself

Enter the corresponding values to try the approximation for yourself.

Specify the full stoichiometry
 

** Use of this web page reqiures correct Citing and attribution in any or all work and/or papers produced from results generated by this service.

API

You can access the single-attribute band gap predictor here:

URL format: /api/v{Version}/MachineLearning/GapType/SpaceGroup

POST

{
    "spaceGroup": 129,
    "stoichiometry": "Ag10O8P2Te2"
}

JSON - response

{
    "halfMetal": 0.0000000001208971313097922044;
    "insulatorDirect": 0.0276288844767050804013304393;
    "insulatorDirectSpinPolarised": 0.000000000000000000333201382;
    "insulatorIndirect": 0.972054870642805564504263858;
    "insulatorIndirectSpinPolarised": 0.0000000000001151086947130958;
    "metal": 0.0003162447594771147566990205;
    "spaceGroup": 129,
    "stoichiometry": "Ag10O8P2Te2"
}

XML - response

<GapTypeSpaceGroupModel xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xmlns:xsd="http://www.w3.org/2001/XMLSchema">
    <HalfMetal>0.0000000001208971313097922044</HalfMetal>
    <InsulatorDirect>0.0276288844767050804013304393</InsulatorDirect>
    <InsulatorDirectSpinPolarised>0.000000000000000000333S201382</InsulatorDirectSpinPolarised>
    <InsulatorIndirect>0.972054870642805564504263858</InsulatorIndirect>
    <InsulatorIndirectSpinPolarised>0.0000000000001151086947130958</InsulatorIndirectSpinPolarised>
    <Metal>0.0003162447594771147566990205</Metal>
    <SpaceGroup>129</SpaceGroup>
    <Stoichiometry>Cr4Cu1In1Se8</Stoichiometry>
</GapTypeSpaceGroupModel>

 

Copyright © 2017-2021 hadokenmaterials.io | Privacy | Terms | Citing | Contact