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  1. Third-Parties
  2. MatprojStructure
  3. mp-1236593

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-1236593
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 11
  • Number of elements: 5
  • Element list: ['Li', 'Ta', 'Nb', 'Ag', 'O']
  • Chemical System: Ag-Li-Nb-O-Ta
  • Density: 7.260076321848738
  • Atomic Density: 0.0811663192946302
  • Unit Cell Volume: 135.52419397102977
  • Molar Volume: 7.419507022537133
  • Full Formula: Li1 Ta1 Nb1 Ag2 O6
  • Reduced Formula: LiTaNb(AgO3)2
  • Formula Anonymous: ABCD2E6
  • Spacegroup Number: 38
  • Spacegroup Symbol: Amm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -82.66758905
  • Final energy per atom: -7.515235368181819
  • 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.