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  1. Third-Parties
  2. MatprojStructure
  3. mp-1076595

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-1076595
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 144
  • Number of elements: 5
  • Element list: ['La', 'Sm', 'Ti', 'V', 'O']
  • Chemical System: La-O-Sm-Ti-V
  • Density: 6.145654827874856
  • Atomic Density: 0.07225107816586054
  • Unit Cell Volume: 1993.0498430685238
  • Molar Volume: 8.335018539343446
  • Full Formula: La28 Sm4 Ti8 V24 O80
  • Reduced Formula: La7SmTi2V6O20
  • Formula Anonymous: AB2C6D7E20
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -1270.56852269
  • Final energy per atom: -8.823392518680556
  • 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.