Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: jvasp-4663
  • 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: 4
  • Number of elements: 3
  • Element list: ['Tl', 'Ag', 'Te']
  • Chemical System: Ag-Te-Tl
  • Density: 7.826437371923715
  • Atomic Density: 0.033223567137869496
  • Unit Cell Volume: 120.39646385353507
  • Molar Volume: 18.126111308306005
  • Full Formula: Tl1 Ag1 Te2
  • Reduced Formula: TlAgTe2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 119
  • Spacegroup Symbol: I-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2