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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-16763
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Ti', 'Te', 'P']
  • Chemical System: P-Te-Ti
  • Density: 5.672820318650482
  • Atomic Density: 0.044726143163472926
  • Unit Cell Volume: 111.79144112035607
  • Molar Volume: 13.464475883800725
  • Full Formula: Ti2 Te2 P1
  • Reduced Formula: Ti2Te2P
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m