{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.7468011e-10 5.883441e-11 2.7165924e-10 ] [ 1.3967784e-10 2.5045087e-10 2.7186144e-10 ] [ 1.4552567e-10 2.6137308e-10 5.024094800000001e-10 ] [ 3.6095039e-10 2.7349685e-10 2.1168823e-10 ] [ 3.0775218e-10 9.403272e-11 5.030144700000001e-10 ] [ 4.8371999e-10 1.3374914e-10 3.5353483e-10 ] [ 3.6562861e-10 3.1853162e-10 4.4360982e-10 ] ] "source-value" [ [ 2.7468011 0.5883441 2.7165924 ] [ 1.3967784 2.5045087 2.7186144 ] [ 1.4552567 2.6137308 5.0240948 ] [ 3.6095039 2.7349685 2.1168823 ] [ 3.0775218 0.9403272 5.0301447 ] [ 4.8371999 1.3374914 3.5353483 ] [ 3.6562861 3.1853162 4.4360982 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.919885320449281e-12 -1.7776149607776e-11 -2.646267059276736e-11 ] [ -4.563367516661183e-11 -5.447993316069696e-11 -5.146415610736512e-11 ] [ -2.017492844443776e-11 2.831382546043968e-11 3.778461190131265e-11 ] [ -1.661969852288256e-11 1.700021547032256e-11 -3.449277981621696e-11 ] [ -2.976619856719488e-11 -2.444713240380096e-11 -5.1846435449088e-12 ] [ 3.070186971374208e-11 -1.688710180089408e-11 3.94584058170624e-12 ] [ 8.541235609017216e-11 6.827627604240575e-11 7.587363736057729e-11 ] ] "source-value" [ [ -0.0024466 -0.011095 -0.0165167 ] [ -0.0284823 -0.0340037 -0.0321214 ] [ -0.0125922 0.0176721 0.0235833 ] [ -0.0103732 0.0106107 -0.0215287 ] [ -0.0185786 -0.0152587 -0.003236 ] [ 0.0191626 -0.0105401 0.0024628 ] [ 0.0533102 0.0426147 0.0473566 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.860505911013455e-18 "source-value" -30.336892 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.674313761557046e-09 -1.241026495960439e-08 7.043204954663754e-09 ] [ 2.954544907020443e-09 -3.133094834213299e-10 -8.51825767257469e-09 ] [ -1.083302589747181e-09 1.302155109618599e-09 7.40637641757165e-09 ] [ 6.913162526842239e-09 1.454107831447839e-08 -5.3097751411699e-10 ] [ 1.678021098546079e-09 1.157576934404876e-09 1.313616600510816e-10 ] [ -4.472885393089814e-09 1.66704779087022e-09 -3.7352174818299e-09 ] [ -1.315226948232382e-09 -5.944283706346366e-09 -1.796490363764907e-09 ] ] "source-value" [ [ -2.9174772 -7.7458782 4.3960228 ] [ 1.8440819 -0.1955524 -5.3166783 ] [ -0.6761443 0.8127413 4.6226966 ] [ 4.3148567 9.0758273 -0.3314101 ] [ 1.0473384 0.7225027 0.0819895 ] [ -2.7917555 1.0404894 -2.3313394 ] [ -0.8209001 -3.7101301 -1.1212811 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.05772714406085e-18 "source-value" -25.326341 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] "source-value" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] } "instance-id" 1 }