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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-35499
  • 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: 7
  • Number of elements: 3
  • Element list: ['Mn', 'N', 'Cl']
  • Chemical System: Cl-Mn-N
  • Density: 2.355534698034133
  • Atomic Density: 0.044178683348929194
  • Unit Cell Volume: 158.4474563153695
  • Molar Volume: 13.631326928501515
  • Full Formula: Mn1 N2 Cl4
  • Reduced Formula: Mn(NCl2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm