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  1. Third-Parties
  2. MatprojStructure
  3. mp-1215002

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-1215002
  • 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: 46
  • Number of elements: 7
  • Element list: ['Ag', 'H', 'C', 'S', 'N', 'Cl', 'O']
  • Chemical System: Ag-C-Cl-H-N-O-S
  • Density: 2.575937398817746
  • Atomic Density: 0.07665739429229394
  • Unit Cell Volume: 600.0725751856686
  • Molar Volume: 7.855916334747347
  • Full Formula: Ag4 H16 C4 S4 N10 Cl2 O6
  • Reduced Formula: Ag2H8C2S2N5ClO3
  • Formula Anonymous: AB2C2D2E3F5G8
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -261.41536536
  • Final energy per atom: -5.682942725217392
  • 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.