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-122116
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 24
  • Number of elements: 4
  • Element list: ['Li', 'Nd', 'Mo', 'O']
  • Chemical System: Li-Mo-Nd-O
  • Density: 5.119473055386763
  • Atomic Density: 0.07853854330667577
  • Unit Cell Volume: 305.58244384907
  • Molar Volume: 7.667752044349566
  • Full Formula: Li2 Nd2 Mo4 O16
  • Reduced Formula: LiNd(MoO4)2
  • Formula Anonymous: ABC2D8
  • Spacegroup Number: 13
  • Spacegroup Symbol: P12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m