{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -125.5889752 -100.4385574 -97.5790512 ] [ -21.5519076 155.6771784 84.1292524 ] [ 278.3787797 -94.7160606 -6.6462734 ] [ -19.8889231 -27.1710993 -15.3552146 ] [ 21.0236827 -38.8047568 6.8128507 ] [ 4.4944943 57.7873273 35.8145956 ] [ -136.8671509 47.6659684 -7.1761594 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.01215719895671e-07 -1.609203084931588e-07 -1.563388745124862e-07 ] [ -3.452996249036184e-08 2.494223356245908e-07 1.347899213206623e-07 ] [ 4.460119725621737e-07 -1.51751857907596e-07 -1.064850385692493e-08 ] [ -3.186556760370906e-08 -4.353290005989525e-08 -2.460176583948683e-08 ] [ 3.368365290505742e-08 -6.217207412078982e-08 1.091539011254091e-08 ] [ 7.200973689778863e-09 9.258550477857759e-08 5.738130775372654e-08 ] [ -2.192853493274857e-07 7.636930017827159e-08 -1.149747481781416e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 106.41859 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.705013769165007e-17 } "relaxed-configuration-positions" { "source-value" [ [ 2.7720645 1.9106593 0.8255295 ] [ 2.072579 4.526199 1.4697889 ] [ 5.3598056 2.554703 1.7334635 ] [ 3.3351405 0.7777877 3.3267012 ] [ 6.5187216 0.6452185 3.8923322 ] [ 4.5180518 2.9456643 4.7343862 ] [ 4.4542211 4.9976722 2.8316912 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7720645e-10 1.9106593e-10 8.255295000000001e-11 ] [ 2.072579e-10 4.526199e-10 1.4697889e-10 ] [ 5.3598056e-10 2.554703e-10 1.7334635e-10 ] [ 3.3351405e-10 7.777877e-11 3.3267012e-10 ] [ 6.5187216e-10 6.452185000000001e-11 3.8923322e-10 ] [ 4.5180518e-10 2.9456643e-10 4.7343862e-10 ] [ 4.4542211e-10 4.9976722e-10 2.8316912e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.32e-05 -2.4e-06 -7.5e-05 ] [ 3.78e-05 5.3e-06 7.5e-06 ] [ -4.92e-05 -0.0001147 0.000154 ] [ 0.0001597 9.69e-05 -2.81e-05 ] [ -5.2e-05 3.08e-05 1.78e-05 ] [ 5.13e-05 -7.97e-05 -7.77e-05 ] [ -5.42e-05 6.39e-05 1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.4932286105856e-13 -3.84522388992e-15 -1.2016324656e-13 ] [ 6.056227626623999e-14 8.491536090240001e-15 1.2016324656e-14 ] [ -7.882708974336e-14 -1.8376965840576e-13 2.467351996032e-13 ] [ 2.5586760634176e-13 1.5525091455552e-13 -4.502116304448e-14 ] [ -8.33131842816e-14 4.934703992064001e-14 2.851874385024e-14 ] [ 8.219166064704e-14 -1.2769347667776e-13 -1.2448912343616e-13 ] [ -8.683797284736e-14 1.0237908606912e-13 2.56348259328e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.28791 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.930046184529453e-18 } }