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-39783
  • 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: 4
  • Number of elements: 3
  • Element list: ['Ac', 'Si', 'Pd']
  • Chemical System: Ac-Pd-Si
  • Density: 8.598875731149862
  • Atomic Density: 0.0351967076254191
  • Unit Cell Volume: 113.64699342250965
  • Molar Volume: 17.109954783528682
  • Full Formula: Ac2 Si1 Pd1
  • Reduced Formula: Ac2SiPd
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m