{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.9613832 -10.1247545 -13.4003213 ] [ -9.2892555 -3.9106755 12.0136745 ] [ -1.8509534 7.5020074 -5.1430248 ] [ 9.2141622 -6.1401435 -3.6966894 ] [ 12.8874299 12.673566 10.2263609 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.756207189466989e-08 -1.622164495123959e-08 -2.146968149806826e-08 ] [ -1.488302798673781e-08 -6.265592857635351e-09 1.924802841380113e-08 ] [ -2.965554263670271e-09 1.201954086534859e-08 -8.240034094754597e-09 ] [ 1.476271525709909e-08 -9.837594364057085e-09 -5.92274933103918e-09 ] [ 2.064793888797888e-08 2.030529114736577e-08 1.638443634984324e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.4579544 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.938077074672492e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8825401 1.6279109 2.153775 ] [ 1.7364437 2.077672 4.7037925 ] [ 2.4472383 4.1582377 2.0847837 ] [ 4.4140485 1.4249077 2.6795645 ] [ 3.8492775 3.4793028 4.1583084 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8825401e-10 1.6279109e-10 2.153775e-10 ] [ 1.7364437e-10 2.077672e-10 4.7037925e-10 ] [ 2.4472383e-10 4.1582377e-10 2.0847837e-10 ] [ 4.4140485e-10 1.4249077e-10 2.6795645e-10 ] [ 3.8492775e-10 3.4793028e-10 4.1583084e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.17e-05 -9.7e-06 -7e-07 ] [ -4e-07 4.8e-06 -1.82e-05 ] [ 1.3e-06 -1.75e-05 2.7e-06 ] [ -8.1e-06 1.13e-05 -6.3e-06 ] [ 1.89e-05 1.11e-05 2.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.874546646336e-14 -1.554111322176e-14 -1.12152363456e-15 ] [ -6.408706483200001e-16 7.69044777984e-15 -2.915961449856e-14 ] [ 2.08282960704e-15 -2.8038090864e-14 4.32587687616e-15 ] [ -1.297763062848e-14 1.810459581504e-14 -1.009371271104e-14 ] [ 3.028113813312e-14 1.778416049088e-14 3.604897396800001e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.5001568 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.522092911889414e-18 } }