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  1. Third-Parties
  2. MatprojStructure
  3. mp-8153

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-8153
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 14
  • Number of elements: 4
  • Element list: ['Na', 'Hg', 'P', 'O']
  • Chemical System: Hg-Na-O-P
  • Density: 5.642204476465247
  • Atomic Density: 0.07466526519755565
  • Unit Cell Volume: 187.5035193802315
  • Molar Volume: 8.065518476451015
  • Full Formula: Na2 Hg2 P2 O8
  • Reduced Formula: NaHgPO4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -83.22248413999999
  • Final energy per atom: -5.944463152857142
  • 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.