{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0214054 -2.8287113 4.6797187 ] [ -3.7568289 4.5830793 -3.0125746 ] [ 9.1187336 -3.9617309 -0.6142239 ] [ 8.156726 9.893898 -0.625186 ] [ -7.6663942 -2.2438464 -10.4445818 ] [ -4.5459588 -7.2533197 6.8427593 ] [ 2.7151277 1.810631 3.1740882 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.443001714638872e-09 -4.532095111852775e-09 7.497735893060569e-09 ] [ -6.019103431925781e-09 7.342902505732429e-09 -4.826676592535912e-09 ] [ 1.460982178522342e-08 -6.347392625880943e-09 -9.84095172516597e-10 ] [ 1.30685156994715e-08 1.585177206417988e-08 -1.001658392851469e-09 ] [ -1.228291755307672e-08 -3.595038242746245e-09 -1.673406477399318e-08 ] [ -7.283428908480023e-09 -1.162109924652807e-08 1.096330897222177e-08 ] [ 4.350114123426476e-09 2.900950657095725e-09 5.085449906397154e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2634111 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.484162069327921e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1857403 2.4097813 4.7257144 ] [ 2.4729846 3.4020045 2.5083756 ] [ 5.1330274 1.3115468 2.611081 ] [ 4.8325684 3.6365952 3.1091539 ] [ 2.8050285 1.2756445 1.4383879 ] [ 3.0819912 0.3608809 3.8637747 ] [ 4.1773877 3.5517738 5.4126906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1857403e-10 2.4097813e-10 4.725714400000001e-10 ] [ 2.4729846e-10 3.4020045e-10 2.5083756e-10 ] [ 5.1330274e-10 1.3115468e-10 2.611081e-10 ] [ 4.8325684e-10 3.6365952e-10 3.1091539e-10 ] [ 2.8050285e-10 1.2756445e-10 1.4383879e-10 ] [ 3.0819912e-10 3.608809e-11 3.8637747e-10 ] [ 4.1773877e-10 3.5517738e-10 5.412690600000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.42e-05 1.67e-05 2.23e-05 ] [ -2.93e-05 -3.48e-05 -4.5e-05 ] [ 9.4e-06 -5.6e-06 -4.2e-06 ] [ 5.9e-06 -2.3e-06 2.02e-05 ] [ 1.8e-06 4.33e-05 -1.1e-06 ] [ -1.39e-05 -2.31e-05 6.4e-06 ] [ -8.2e-06 5.8e-06 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.479444043136e-14 2.675634956736e-14 3.572853864384e-14 ] [ -4.694377498944e-14 -5.575574640383999e-14 -7.209794793600001e-14 ] [ 1.506046023552e-14 -8.972189076479999e-15 -6.72914180736e-15 ] [ 9.45284206272e-15 -3.68500622784e-15 3.236396774016e-14 ] [ 2.88391791744e-15 6.937424768064e-14 -1.76239428288e-15 ] [ -2.227025502912e-14 -3.701027994048e-14 1.025393037312e-14 ] [ -1.313784829056e-14 9.292624400640001e-15 2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }