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  1. Third-Parties
  2. MatprojStructure
  3. mp-1096869

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-1096869
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 71
  • Number of elements: 1
  • Element list: ['C']
  • Chemical System: C
  • Density: 0.9956655665045799
  • Atomic Density: 0.04992247074231997
  • Unit Cell Volume: 1422.2052503465602
  • Molar Volume: 12.062986207321162
  • Full Formula: C71
  • Reduced Formula: C
  • Formula Anonymous: A
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -646.86646431
  • Final energy per atom: -9.110795271971831
  • 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.