Download Simmate

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

learn more
  1. Third-Parties
  2. MatprojStructure
  3. mp-757304

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-757304
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 67
  • Number of elements: 3
  • Element list: ['Sr', 'V', 'O']
  • Chemical System: O-Sr-V
  • Density: 5.010428376135057
  • Atomic Density: 0.076658159101362
  • Unit Cell Volume: 874.0100308358382
  • Molar Volume: 7.855837957231878
  • Full Formula: Sr16 V12 O39
  • Reduced Formula: Sr16V12O39
  • Formula Anonymous: A12B16C39
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -526.3614874
  • Final energy per atom: -7.856141602985074
  • 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.