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-105364
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 2
  • Element list: ['Ti', 'Mo']
  • Chemical System: Mo-Ti
  • Density: 8.382080246001566
  • Atomic Density: 0.06316416946257639
  • Unit Cell Volume: 47.49528135215085
  • Molar Volume: 9.534108991281851
  • Full Formula: Ti1 Mo2
  • Reduced Formula: TiMo2
  • Formula Anonymous: AB2
  • Spacegroup Number: 69
  • Spacegroup Symbol: Fmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm