Simmate

Download Simmate

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

learn more

Due to limited resources, our website only includes a small number of features compared to the many available in the command-line and python. We highly recommend installing Simmate for local use, rather than just relying on the website.

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-568144
Created at: Sept. 4, 2022, 2:46 p.m.
Last updated at: Nov. 28, 2021, 1:37 a.m.
Input Source: Materials Project

Structure:

Number of sites: 16
Number of elements: 2
Element list: ['Dy', 'In']
Chemical System: Dy-In
Density: 8.482260255253243
Atomic Density: 0.0353212765504877
Unit Cell Volume: 452.9847605346268
Molar Volume: 17.0496124379651
Full Formula: Dy10 In6
Reduced Formula: Dy5In3
Formula Anonymous: A3B5
Spacegroup Number: 140
Spacegroup Symbol: I4/mcm
Crystal System: tetragonal
Pointgroup: 4/mmm

Thermodynamics:

Final energy: -68.67956802
Final energy per atom: -4.29247300125
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.