{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.44714 0 0 ] "si-unit" "m" "si-value" [ 5.44714e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103058 5.37075 0 ] "si-unit" "m" "si-value" [ 1.03058e-11 5.37075e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0454409 0.00880856 5.43207 ] "si-unit" "m" "si-value" [ 4.54409e-12 8.808560000000001e-13 5.432070000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.092279 -0.1565 0.140236 ] [ 1.30169 1.48453 1.67094 ] [ -0.064284 2.41697 2.49469 ] [ 1.35107 4.20911 4.05148 ] [ 2.6753 0.0424873 2.71018 ] [ 4.05146 1.3988 4.09778 ] [ 2.74223 2.69898 0.420733 ] [ 4.21922 4.15138 1.78205 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.227900000000001e-12 -1.565e-11 1.40236e-11 ] [ 1.30169e-10 1.48453e-10 1.67094e-10 ] [ -6.4284e-12 2.41697e-10 2.49469e-10 ] [ 1.35107e-10 4.20911e-10 4.05148e-10 ] [ 2.6753e-10 4.24873e-12 2.71018e-10 ] [ 4.05146e-10 1.3988e-10 4.09778e-10 ] [ 2.74223e-10 2.69898e-10 4.20733e-11 ] [ 4.21922e-10 4.15138e-10 1.78205e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.13585130000000004 2.1836174000000006 0.20331530000000006 ] [ 5.102309600000001 -5.048101400000001 -5.097364600000001 ] [ -5.255922600000001 4.733157900000001 5.644068600000001 ] [ 0.3625127000000001 -2.3898283000000005 0.36904430000000005 ] [ -0.7802164000000003 1.0605599000000003 2.0995816000000005 ] [ -0.21611260000000004 -0.5322916000000001 1.5394235000000005 ] [ 0.6111267000000001 1.1785189000000003 -2.1984610000000004 ] [ 0.31215400000000004 -1.1856328000000003 -2.5596077000000004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.176577767652871e-10 3.498540747052083e-09 3.257470203109383e-10 ] [ 8.1748011532034e-09 -8.087950042507751e-09 -8.166878389813544e-09 ] [ -8.420916310454352e-09 7.583354929934826e-09 9.042794757111388e-09 ] [ 5.808093726830843e-10 -3.828927029986209e-09 5.912741494995015e-10 ] [ -1.250044475244742e-09 1.699204276737986e-09 3.363900552981858e-09 ] [ -3.462505551803021e-10 -8.528251569682254e-10 2.46642834121011e-09 ] [ 9.791329110866556e-10 1.888195428750934e-09 -3.52232281594059e-09 ] [ 5.001258408892033e-10 -1.899593153013643e-09 -4.100943615359661e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.887548240654233 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.225030511140839e-18 } }