./Job.xml output for 1006: Bulk_VBiO4_sp

Status: finished

<?xml version='1.0'?>
<!DOCTYPE MDRESULTS PUBLIC "-//MD//DTD MDRESULTS 1.0" "http://materialsdesign.com/DTD/mdresults_1_0.dtd">

<MDRESULTS>
  <System id="initial">
    <Date> 6 Apr 2025 18:14:35 GMT</Date>
    <Characterization>
      <PropertyValue property="symmetry" type="text" units="">P1</PropertyValue>
      <PropertyValue property="setting" type="text" units="">P1</PropertyValue>
      <PropertyValue property="empirical formula" type="text" units="">VBiO4</PropertyValue>
      <PropertyValue property="primitive cell formula" type="text" units="">V4Bi4O16</PropertyValue>
      <PropertyValue property="primitive Z" type="text" units="">4</PropertyValue>
    </Characterization>
  </System>
  <Calculation id="initial">
    <Date> 6 Apr 2025 18:14:35 GMT</Date>
    <System>initial</System>
    <Results>
      <PropertyValue property="VASP energy" type="float" units="eV">-183.598268</PropertyValue>
      <PropertyValue property="Fermi energy" type="float" units="eV">5.669800</PropertyValue>
      <PropertyValue dimensions="3 24" property="atomic derivatives" type="float" units="kJ/mol/m">0.000 0.000 0.000
0.000 0.000 0.000
0.000 0.000 0.000
0.000 0.000 0.000
0.000 0.000 0.000
0.000 0.000 0.000
0.000 0.000 0.000
0.000 0.000 0.000
2052133731.703 1211521198.656 734022621.419
-1211521198.656 2052133731.703 734022621.419
1211521198.656 -2052133731.703 734022621.419
-2052133731.703 -1211521198.656 734022621.419
2052133731.703 1211521198.656 -734022621.419
-1211521198.656 2052133731.703 -734022621.419
-2052133731.703 -1211521198.656 -734022621.419
1211521198.656 -2052133731.703 -734022621.419
2052133731.703 1211521198.656 734022621.419
-1211521198.656 2052133731.703 734022621.419
1211521198.656 -2052133731.703 734022621.419
-2052133731.703 -1211521198.656 734022621.419
2052133731.703 1211521198.656 -734022621.419
-1211521198.656 2052133731.703 -734022621.419
-2052133731.703 -1211521198.656 -734022621.419
1211521198.656 -2052133731.703 -734022621.419</PropertyValue>
      <PropertyValue property="cell volume" type="float" units="Ang^3">297.740</PropertyValue>
      <PropertyValue property="pressure" type="float" units="GPa">-0.735</PropertyValue>
      <PropertyValue dimensions="6" property="stress" type="float" units="GPa">0.68743 0.68743 0.83023 -0.00000 -0.00000 -0.00000</PropertyValue>
      <PropertyValue property="magnetic moment" type="float" units="ub">0.0000</PropertyValue>
    </Results>
  </Calculation>
</MDRESULTS>