{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8070865 2.620947 2.881943 ] [ 2.981493 2.883992 2.450576 ] [ 2.14387 2.287305 4.61196 ] [ 1.117537 4.809867 2.516966 ] [ 2.97789 5.94727 2.412215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.070865000000001e-11 2.620947e-10 2.881943e-10 ] [ 2.981493e-10 2.883992e-10 2.450576e-10 ] [ 2.14387e-10 2.287305e-10 4.61196e-10 ] [ 1.117537e-10 4.809867e-10 2.516966e-10 ] [ 2.97789e-10 5.947269999999999e-10 2.412215e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7313522 -0.9348048 -0.611487 ] [ 2.9221788 1.3213804 -0.7717565 ] [ 1.0510331 -0.5924022 1.7543033 ] [ -1.2403898 0.8083403 -0.3654878 ] [ 0.9985301 -0.6025137 -0.005572 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.978285258810645e-09 -1.49772239557162e-09 -9.797101753231296e-10 ] [ 4.681846555157399e-09 2.117084784063352e-09 -1.236490221250435e-09 ] [ 1.683940660506949e-09 -9.491329549504858e-10 2.810703733052288e-09 ] [ -1.987323538238788e-09 1.295103930310458e-09 -5.855760083476263e-10 ] [ 1.599821581385086e-09 -9.65333363851705e-10 -8.9273281310976e-12 ] ] } "unrelaxed-potential-energy" { "source-value" -11.658873 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.867957374547636e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2688348 2.9583726 3.3556107 ] [ 3.9058425 3.4081259 3.1297199 ] [ 2.2701671 2.0056139 3.8416499 ] [ 0.6676208 4.9496557 2.3431496 ] [ 2.9154113 5.227613 2.2035299 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.688348e-11 2.9583726e-10 3.3556107e-10 ] [ 3.9058425e-10 3.4081259e-10 3.1297199e-10 ] [ 2.2701671e-10 2.0056139e-10 3.8416499e-10 ] [ 6.676208000000001e-11 4.9496557e-10 2.3431496e-10 ] [ 2.9154113e-10 5.227613e-10 2.2035299e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.23e-05 1.29e-05 -2.46e-05 ] [ -3.65e-05 -4.9e-06 -1.91e-05 ] [ 9.5e-06 4e-07 2.43e-05 ] [ -4.6e-06 -1.3e-06 5.4e-06 ] [ -7e-07 -7.1e-06 1.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.175030485184e-14 2.066807840832e-14 -3.941354487168e-14 ] [ -5.84794466592e-14 -7.850665441919999e-15 -3.060157345728e-14 ] [ 1.52206778976e-14 6.408706483200001e-16 3.893289188544e-14 ] [ -7.370012455680001e-15 -2.08282960704e-15 8.65175375232e-15 ] [ -1.12152363456e-15 -1.137545400768e-14 2.24304726912e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.066442 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.41391011310392e-18 } }