Download Simmate

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

learn more

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-758482
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 67
  • Number of elements: 3
  • Element list: ['V', 'Bi', 'O']
  • Chemical System: Bi-O-V
  • Density: 8.562833825495554
  • Atomic Density: 0.059842878592305505
  • Unit Cell Volume: 1119.5985483327793
  • Molar Volume: 10.063253810077104
  • Full Formula: V2 Bi24 O41
  • Reduced Formula: V2Bi24O41
  • Formula Anonymous: A2B24C41
  • Spacegroup Number: 16
  • Spacegroup Symbol: P222
  • Crystal System: orthorhombic
  • Pointgroup: 222

Thermodynamics:

  • Final energy: -430.03417624
  • Final energy per atom: -6.418420540895522
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.