Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-121977
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 15
  • Number of elements: 5
  • Element list: ['Fe', 'Cu', 'As', 'Pb', 'O']
  • Chemical System: As-Cu-Fe-O-Pb
  • Density: 5.396628390587993
  • Atomic Density: 0.07659761731668444
  • Unit Cell Volume: 195.82854565807378
  • Molar Volume: 7.862047111860048
  • Full Formula: Fe1 Cu1 As2 Pb1 O10
  • Reduced Formula: FeCuAs2PbO10
  • Formula Anonymous: ABCD2E10
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1