{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4274107 1.04679 0.754155 ] [ 0.054848 0.4363706 2.670546 ] [ 0.7705138 1.600976 2.469626 ] [ 2.416605 0.1528458 1.19099 ] [ 2.213379 0.2126116 2.884964 ] [ 2.109765 2.603732 2.132719 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.274107e-11 1.04679e-10 7.541550000000001e-11 ] [ 5.4848e-12 4.363706e-11 2.670546e-10 ] [ 7.705138e-11 1.600976e-10 2.469626e-10 ] [ 2.416605e-10 1.528458e-11 1.19099e-10 ] [ 2.213379e-10 2.126116e-11 2.884964e-10 ] [ 2.109765e-10 2.603732e-10 2.132719e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.0038016 -0.533217 -41.925404 ] [ -60.7122683 -66.3752262 26.5588457 ] [ 0.9223903 66.2103998 15.685579 ] [ 26.2563957 -18.0021416 -33.9307771 ] [ 23.5993254 -19.9926325 35.9192524 ] [ 29.9379585 38.6928175 -2.3074959 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.204962325064163e-08 -8.543078112131137e-10 -6.71719021063948e-08 ] [ -9.727177686599695e-08 -1.063448356179516e-07 4.255196165597461e-08 ] [ 1.477832173912698e-09 1.06080754613381e-07 2.513106795751144e-08 ] [ 4.206738333701365e-08 -2.884261039585111e-08 -5.436309779519603e-08 ] [ 3.781028742253161e-08 -3.203172837974626e-08 5.754898643189428e-08 ] [ 4.796589718318063e-08 6.19927275913811e-08 -3.697015983571855e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 49.227538 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.88712104831436e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1908411 0.6961554 0.5043077 ] [ -0.0038153 0.0558201 3.0154293 ] [ 0.228223 2.5503918 2.3247865 ] [ 2.5781851 0.5123865 0.6422912 ] [ 2.383524 -0.1280034 3.1534088 ] [ 2.6155636 2.3665756 2.4627765 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.908411e-11 6.961554e-11 5.043077000000001e-11 ] [ -3.8153e-13 5.58201e-12 3.0154293e-10 ] [ 2.28223e-11 2.5503918e-10 2.3247865e-10 ] [ 2.5781851e-10 5.123865e-11 6.422912e-11 ] [ 2.383524e-10 -1.280034e-11 3.1534088e-10 ] [ 2.6155636e-10 2.3665756e-10 2.4627765e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.66e-05 3e-05 4.7e-06 ] [ 1.61e-05 4.11e-05 -5.21e-05 ] [ 2.3e-06 -7.09e-05 -1.54e-05 ] [ -2.77e-05 -2.91e-05 4.9e-06 ] [ 3.52e-05 6.9e-06 2.77e-05 ] [ 1.08e-05 2.19e-05 3.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.863966432128e-14 4.8065298624e-14 7.53023011776e-15 ] [ 2.579504359488e-14 6.584945911488e-14 -8.347340194367999e-14 ] [ 3.68500622784e-15 -1.1359432241472e-13 -2.467351996032e-14 ] [ -4.438029239616e-14 -4.662333966527999e-14 7.850665441919999e-15 ] [ 5.639661705216e-14 1.105501868352e-14 4.438029239616e-14 ] [ 1.730350750464e-14 3.508766799552e-14 4.822551628608e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.187542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.273094809901807e-18 } }