Download Simmate

You can install Simmate to host your own server and access advanced features

learn more
  1. Third-Parties
  2. MatprojStructure
  3. mp-776070

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-776070
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 28
  • Number of elements: 5
  • Element list: ['Li', 'Ni', 'Sn', 'P', 'O']
  • Chemical System: Li-Ni-O-P-Sn
  • Density: 3.8074498275669946
  • Atomic Density: 0.0780587429887726
  • Unit Cell Volume: 358.7042133643801
  • Molar Volume: 7.714883086019179
  • Full Formula: Li4 Ni1 Sn3 P4 O16
  • Reduced Formula: Li4NiSn3(PO4)4
  • Formula Anonymous: AB3C4D4E16
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -192.58011796
  • Final energy per atom: -6.877861355714286
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.