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  1. Third-Parties
  2. MatprojStructure
  3. mp-1235008

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-1235008
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 43
  • Number of elements: 7
  • Element list: ['Mg', 'Zn', 'H', 'Pt', 'C', 'N', 'O']
  • Chemical System: C-H-Mg-N-O-Pt-Zn
  • Density: 2.045634344369198
  • Atomic Density: 0.08813715313756534
  • Unit Cell Volume: 487.8759804379564
  • Molar Volume: 6.832692622372977
  • Full Formula: Mg1 Zn1 H20 Pt1 C4 N4 O12
  • Reduced Formula: MgZnH20PtC4(NO3)4
  • Formula Anonymous: ABCD4E4F12G20
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -248.46556409
  • Final energy per atom: -5.778268932325581
  • 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.