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: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-999646
  • Created at: Sept. 4, 2022, 3:26 p.m.
  • Last updated at: Sept. 4, 2022, 3:26 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 4
  • Element list: ['Ca', 'Cu', 'Pd', 'V']
  • Chemical System: Ca-Cu-Pd-V
  • Density: 6.040999651610087
  • Atomic Density: 0.05575750414590692
  • Unit Cell Volume: 71.73922257231513
  • Molar Volume: 10.800592408586276
  • Full Formula: Ca1 V1 Cu1 Pd1
  • Reduced Formula: CaVCuPd
  • Formula Anonymous: ABCD
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m