{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0755506 0.3541964 0.6731301 ] [ 0.5631114 0.1579036 2.39025 ] [ 0.1113923 2.692001 2.732528 ] [ 1.634511 1.700059 1.731597 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.555059999999999e-12 3.541964e-11 6.731301e-11 ] [ 5.631114000000001e-11 1.579036e-11 2.39025e-10 ] [ 1.113923e-11 2.692001e-10 2.732528e-10 ] [ 1.634511e-10 1.700059e-10 1.731597e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.532622 -2.2978952 -32.8829986 ] [ 0.2066881 -20.9925613 33.1458548 ] [ -7.6875408 10.3767614 5.8994535 ] [ 21.0134747 12.9136951 -6.1623098 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.168165076515435e-08 -3.681633996820757e-09 -5.268437201277471e-08 ] [ 3.311508443458554e-10 -3.363379120267266e-08 5.310551407451674e-08 ] [ -1.231679824268166e-08 1.662540465167312e-08 9.451966551069517e-09 ] [ 3.366729816349016e-08 2.069002054782029e-08 -9.873108773029212e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.8995505 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.105429859620302e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0013966 0.7284072 -0.0881604 ] [ 0.9247993 -0.3560161 3.2498962 ] [ -0.0070917 3.1012043 2.6579298 ] [ 1.4654611 1.4305646 1.7078394 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3966e-13 7.284072e-11 -8.81604e-12 ] [ 9.247993e-11 -3.560161e-11 3.2498962e-10 ] [ -7.091700000000001e-13 3.1012043e-10 2.6579298e-10 ] [ 1.4654611e-10 1.4305646e-10 1.7078394e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9e-06 0.0 -2.7e-06 ] [ 1.08e-05 -6.1e-06 -1.4e-06 ] [ 1.5e-06 1.79e-05 1.9e-06 ] [ -2.14e-05 -1.18e-05 2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.4419589706e-14 0.0 -4.3258769118e-15 ] [ 1.73035076472e-14 -9.773277467399999e-15 -2.2430472876e-15 ] [ 2.403264951e-15 2.86789617486e-14 3.0441356046e-15 ] [ -3.42865799676e-14 -1.89056842812e-14 3.685006258199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.1265651 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.462236935189987e-18 } }