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  1. Third-Parties
  2. MatprojStructure
  3. mp-754568

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-754568
  • 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: 26
  • Number of elements: 6
  • Element list: ['Na', 'Li', 'Mn', 'P', 'C', 'O']
  • Chemical System: C-Li-Mn-Na-O-P
  • Density: 2.811212025183829
  • Atomic Density: 0.08125270037492824
  • Unit Cell Volume: 319.989365030663
  • Molar Volume: 7.411619222760287
  • Full Formula: Na5 Li1 Mn2 P2 C2 O14
  • Reduced Formula: Na5LiMn2P2(CO7)2
  • Formula Anonymous: AB2C2D2E5F14
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -187.10740055
  • Final energy per atom: -7.196438482692307
  • 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.