{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44714e-10 0.0 0.0 ] "source-value" [ 5.44714 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.03058e-11 5.37075e-10 0.0 ] "source-value" [ 0.103058 5.37075 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.54409e-12 8.808560000000001e-13 5.432070000000001e-10 ] "source-value" [ 0.0454409 0.00880856 5.43207 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.949516656082446e-09 -1.038166005898939e-08 3.005110402261202e-09 ] [ 2.093963789270354e-08 -4.639307484133863e-09 -1.023276578017689e-08 ] [ -2.088799477346763e-08 2.060207674242614e-09 1.609940704617332e-08 ] [ 1.159839848664094e-09 9.77540171286152e-09 3.494342403434938e-10 ] [ -6.307110060410141e-09 1.850763776359183e-09 9.990250874010544e-09 ] [ 2.854095162038091e-09 1.291606538964914e-09 -1.303712489381081e-08 ] [ -4.729411494022723e-09 -4.156037502601448e-09 4.640553977544844e-09 ] [ 8.920460080577216e-09 4.199025183078809e-09 -1.08148658663457e-08 ] ] "source-value" [ [ -1.2167926000000002 -6.479722600000001 1.8756424000000005 ] [ 13.069494100000004 -2.8956280000000003 -6.386790100000002 ] [ -13.037261000000004 1.2858805000000002 10.048459600000001 ] [ 0.7239151000000001 6.101325900000002 0.21809970000000006 ] [ -3.936588500000001 1.1551559000000002 6.2354242000000015 ] [ 1.7813861000000004 0.8061574000000002 -8.137133400000002 ] [ -2.9518665000000004 -2.5939946000000003 2.8964060000000003 ] [ 5.567713300000001 2.6208254000000006 -6.750108400000002 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.642670012545378e-18 "source-value" -16.494249 } }