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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-102066
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 4
  • Element list: ['K', 'Ta', 'Ag', 'Cl']
  • Chemical System: Ag-Cl-K-Ta
  • Density: 3.560360871615584
  • Atomic Density: 0.03698440512528142
  • Unit Cell Volume: 270.3842326549766
  • Molar Volume: 16.282919083328576
  • Full Formula: K2 Ta1 Ag1 Cl6
  • Reduced Formula: K2TaAgCl6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m