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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-8194
  • 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: 8
  • Number of elements: 2
  • Element list: ['Ca', 'P']
  • Chemical System: Ca-P
  • Density: 2.727022327118685
  • Atomic Density: 0.049391279635130535
  • Unit Cell Volume: 161.9719120277629
  • Molar Volume: 12.192720667469066
  • Full Formula: Ca2 P6
  • Reduced Formula: CaP3
  • Formula Anonymous: AB3
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1