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'] Extra columns: ['mineral_name', 'aflow_id', 'pearson_symbol', 'strukturbericht_symbol', 'nsites_wyckoff']

Base Information:

Database Entry ID: 189
Created at: Sept. 4, 2022, 2:35 p.m.
Last updated at: Sept. 4, 2022, 2:35 p.m.
Input Source: AFLOW Prototypes

Structure:

Number of sites: 84
Number of elements: 1
Element list: ['P']
Chemical System: P
Density: 2.361074038278624
Atomic Density: 0.045905693367854994
Unit Cell Volume: 1829.8383890400003
Molar Volume: 13.11850517482205
Full Formula: P84
Reduced Formula: P
Formula Anonymous: A
Spacegroup Number: 13
Spacegroup Symbol: P12/c1
Crystal System: monoclinic
Pointgroup: 2/m