{ "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" [ [ -0.19803520000000005 2.4286151000000005 0.23677230000000005 ] [ 4.949553400000001 -5.140432500000001 -5.468678800000001 ] [ -4.9231414000000004 4.735042100000001 5.999577000000001 ] [ 0.5487328000000001 -2.5697117000000005 0.3092151000000001 ] [ -0.7745153000000002 1.4335102000000002 2.5445981000000004 ] [ -0.3894132000000001 -0.5163382000000001 1.5080043000000005 ] [ 0.6340610000000001 1.2024158000000003 -2.2422978000000002 ] [ 0.15275790000000003 -1.5731008000000004 -2.8871902000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.172873701495168e-10 3.891070366199574e-09 3.793510466384382e-10 ] [ 7.930058806215258e-09 -8.235880840154206e-09 -8.76178939221116e-09 ] [ -7.887742116958048e-09 7.586373813626293e-09 9.61238208328382e-09 ] [ 8.791668704693954e-10 -4.117132041856418e-09 4.954172080999735e-10 ] [ -1.240910316335501e-09 2.296736547040667e-09 4.076895618740796e-09 ] [ -6.239087300111689e-10 -8.272649992816189e-10 2.416089253431527e-09 ] [ 1.015877718730674e-09 1.926482499112417e-09 -3.592557141629605e-09 ] [ 2.447451380389086e-10 -2.520385344686707e-09 -4.625788676353787e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.04500807419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.531999683280881e-18 } }