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  1. Third-Parties
  2. MatprojStructure
  3. mp-695941

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-695941
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 104
  • Number of elements: 5
  • Element list: ['Ag', 'H', 'Se', 'N', 'O']
  • Chemical System: Ag-H-N-O-Se
  • Density: 3.1944016001610094
  • Atomic Density: 0.09066034721652222
  • Unit Cell Volume: 1147.138778893257
  • Molar Volume: 6.642529997836261
  • Full Formula: Ag12 H52 Se4 N16 O20
  • Reduced Formula: Ag3H13SeN4O5
  • Formula Anonymous: AB3C4D5E13
  • Spacegroup Number: 19
  • Spacegroup Symbol: P2_12_121
  • Crystal System: orthorhombic
  • Pointgroup: 222

Thermodynamics:

  • Final energy: -523.54522672
  • Final energy per atom: -5.034088718461538
  • 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.