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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-56689
  • 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: 18
  • Number of elements: 5
  • Element list: ['K', 'Mo', 'P', 'Cl', 'O']
  • Chemical System: Cl-K-Mo-O-P
  • Density: 3.0559424481733086
  • Atomic Density: 0.05884623990762427
  • Unit Cell Volume: 305.8819055942413
  • Molar Volume: 10.233688285697516
  • Full Formula: K2 Mo2 P2 Cl2 O10
  • Reduced Formula: KMoPClO5
  • Formula Anonymous: ABCDE5
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm