{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.0694946 -1.3762061 -15.88671 ] [ -2.7734051 -8.9539942 14.4145107 ] [ 13.4556317 -13.3079851 -3.1685873 ] [ -1.8268874 8.5104547 17.3265296 ] [ 6.5890968 0.2798433 1.1209368 ] [ 0.4798701 14.2735874 -13.5747692 ] [ 0.1451886 0.5743001 -0.2319105 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.574616855619184e-08 -2.204925238822347e-09 -2.545331534342957e-08 ] [ -4.443484811227487e-09 -1.43458801700188e-08 2.309459204381144e-08 ] [ 2.155829852783536e-08 -2.132174259717475e-08 -5.076636493023796e-09 ] [ -2.926996281114098e-09 1.363525155271748e-08 2.776016064471918e-08 ] [ 1.055689684514809e-08 4.483583927475207e-10 1.795938734354365e-09 ] [ 7.688366552409581e-10 2.286880802722546e-08 -2.174917784499592e-08 ] [ 2.326177805266829e-10 9.20130193543102e-10 -3.715615812180384e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.804845 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.731127005036778e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2806827 1.3585035 1.211168 ] [ 1.8763304 0.9535413 3.7438774 ] [ 4.4253021 0.9759873 2.6866842 ] [ 3.4463465 3.0147947 4.2333038 ] [ 5.2705289 3.3370785 2.0306086 ] [ 2.6497738 3.8582993 1.6285849 ] [ 4.1623676 5.426853 3.2828241 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2806827e-10 1.3585035e-10 1.211168e-10 ] [ 1.8763304e-10 9.535413e-11 3.743877400000001e-10 ] [ 4.4253021e-10 9.759873000000001e-11 2.6866842e-10 ] [ 3.4463465e-10 3.0147947e-10 4.2333038e-10 ] [ 5.270528900000001e-10 3.3370785e-10 2.0306086e-10 ] [ 2.6497738e-10 3.8582993e-10 1.6285849e-10 ] [ 4.1623676e-10 5.426853000000001e-10 3.2828241e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.07e-05 3.48e-05 -2.69e-05 ] [ -2.92e-05 -2.52e-05 -1.19e-05 ] [ -1.51e-05 5.9e-06 5.48e-05 ] [ -2.37e-05 -7.34e-05 2.99e-05 ] [ 0.0001019 6.3e-06 -7.25e-05 ] [ -3.38e-05 -5.66e-05 4.42e-05 ] [ 1.07e-05 0.0001083 -1.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.714328984256e-14 5.575574640383999e-14 -4.309855109952001e-14 ] [ -4.678355732736e-14 -4.037485084416e-14 -1.906590178752e-14 ] [ -2.419286697408e-14 9.45284206272e-15 8.779927881984e-14 ] [ -3.797158591296e-14 -1.1759976396672e-13 4.790508096192e-14 ] [ 1.6326179765952e-13 1.009371271104e-14 -1.16157805008e-13 ] [ -5.415356978304e-14 -9.068319673728001e-14 7.081620663936001e-14 ] [ 1.714328984256e-14 1.7351572803264e-13 -2.819830852608e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.341596 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.73973594033588e-18 } }