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  1. Third-Parties
  2. MatprojStructure
  3. mp-18271

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-18271
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 46
  • Number of elements: 5
  • Element list: ['Na', 'Ti', 'Si', 'P', 'O']
  • Chemical System: Na-O-P-Si-Ti
  • Density: 2.989799037290308
  • Atomic Density: 0.08187002132766372
  • Unit Cell Volume: 561.8662271492128
  • Molar Volume: 7.355733713440637
  • Full Formula: Na10 Ti4 Si4 P2 O26
  • Reduced Formula: Na5Ti2Si2PO13
  • Formula Anonymous: AB2C2D5E13
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -341.60564718
  • Final energy per atom: -7.426209721304348
  • 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.