{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9911695 -2.9655577 -1.0247799 ] [ -3.3785114 4.6441881 0.8651285 ] [ -2.1681581 2.7111405 0.1890966 ] [ 3.4814834 -4.2294989 3.3314039 ] [ -2.5076305 2.0742932 -1.4521147 ] [ 3.1711288 -0.6942256 -1.9227694 ] [ 0.4105183 -1.5403395 0.014035 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.588028613233463e-09 -4.751347253718781e-09 -1.641878410772856e-09 ] [ -5.412972022782627e-09 7.440809657720854e-09 1.386088668107469e-09 ] [ -3.473772246637835e-09 4.343725960591077e-09 3.029661540888444e-10 ] [ 5.577951355138875e-09 -6.776404311108703e-09 5.337497486996472e-09 ] [ -4.017666993805736e-09 3.323384097105089e-09 -2.32654424222792e-09 ] [ 5.080708466764459e-09 -1.11227203504463e-09 -3.080616205250199e-09 ] [ 6.577228280894022e-10 -2.467895955327243e-09 2.248654905819e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -27.253748 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.366531823452423e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2702561 1.968667 2.8210442 ] [ 2.5682118 3.7255898 1.0789708 ] [ 2.265544 4.4286759 3.2194573 ] [ 4.0763215 2.0248377 1.1048315 ] [ 4.7056937 1.6767799 3.2613021 ] [ 4.6106838 4.0386632 2.4720651 ] [ 3.5865762 3.1624394 4.5682122 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2702561e-10 1.968667e-10 2.8210442e-10 ] [ 2.5682118e-10 3.7255898e-10 1.0789708e-10 ] [ 2.265544e-10 4.4286759e-10 3.2194573e-10 ] [ 4.0763215e-10 2.0248377e-10 1.1048315e-10 ] [ 4.7056937e-10 1.6767799e-10 3.2613021e-10 ] [ 4.610683800000001e-10 4.0386632e-10 2.4720651e-10 ] [ 3.5865762e-10 3.1624394e-10 4.5682122e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.95e-05 -2.23e-05 -2.7e-06 ] [ 1.31e-05 5.9e-06 2.5e-06 ] [ -2.2e-06 1.7e-06 -3e-07 ] [ -1.03e-05 -1.18e-05 -6.5e-06 ] [ 2e-06 1.51e-05 2.2e-06 ] [ 8.1e-06 1.11e-05 6.3e-06 ] [ 8.7e-06 3e-07 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.1242444363e-14 -3.572853893819999e-14 -4.3258769118e-15 ] [ 2.09885139054e-14 9.452842140600001e-15 4.005441585e-15 ] [ -3.5247885948e-15 2.7237002778e-15 -4.806529901999999e-16 ] [ -1.65024193302e-14 -1.89056842812e-14 -1.0414148121e-14 ] [ 3.204353268e-15 2.41928671734e-14 3.5247885948e-15 ] [ 1.29776307354e-14 1.77841606374e-14 1.00937127942e-14 ] [ 1.39389367158e-14 4.806529901999999e-16 -2.403264951e-15 ] ] } "relaxed-potential-energy" { "source-value" -30.185082 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.836183307577399e-18 } }