{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9453871 -13.7155907 1.3978549 ] [ -5.5198445 7.4501095 -4.3483948 ] [ 0.7000001 2.2157022 6.6478894 ] [ -0.4008275 0.5094022 -0.8518694 ] [ 7.4770122 4.8660536 -9.8983066 ] [ 0.6890469 -1.3256768 7.0528265 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.719030350825912e-09 -2.197479876000191e-08 2.239610440050722e-09 ] [ -8.843765808351465e-09 1.193639126329998e-08 -6.966896486568292e-09 ] [ 1.121523794777662e-09 3.549946263495126e-09 1.065109297434414e-08 ] [ -6.421964494737119e-10 8.161522954240858e-10 -1.364845236654924e-09 ] [ 1.197949414027637e-08 7.796277313479676e-09 -1.585883542003034e-08 ] [ 1.103974833814716e-09 -2.123968375696958e-09 1.129987372885869e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.504937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.843294108517689e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6109214 0.990283 1.1080466 ] [ 0.8460384 3.6880279 0.601041 ] [ 0.2152262 2.8239207 2.774707 ] [ 2.4401038 0.3606121 2.4502327 ] [ 1.3227439 1.9657791 -0.9496383 ] [ 1.8202156 1.8340945 4.1520493 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.109214e-11 9.902830000000001e-11 1.1080466e-10 ] [ 8.460384e-11 3.6880279e-10 6.01041e-11 ] [ 2.152262e-11 2.8239207e-10 2.774707e-10 ] [ 2.4401038e-10 3.606121e-11 2.4502327e-10 ] [ 1.3227439e-10 1.9657791e-10 -9.496383e-11 ] [ 1.8202156e-10 1.8340945e-10 4.1520493e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.38e-05 -0.0001027 -1.77e-05 ] [ 5.35e-05 8.26e-05 -1.94e-05 ] [ -5.66e-05 -1.17e-05 2.95e-05 ] [ -7.8e-06 2.18e-05 2.15e-05 ] [ -8.3e-06 4.8e-06 -1.98e-05 ] [ 4.31e-05 5.2e-06 5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.813180357504e-14 -1.6454353895616e-13 -2.835852618816e-14 ] [ 8.57164492128e-14 1.3233978887808e-13 -3.108222644352e-14 ] [ -9.068319673728001e-14 -1.874546646336e-14 4.72642103136e-14 ] [ -1.249697764224e-14 3.492745033344e-14 3.44467973472e-14 ] [ -1.329806595264e-14 7.69044777984e-15 -3.172309709184e-14 ] [ 6.905381235648e-14 8.33131842816e-15 9.45284206272e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.757214 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.005236974214246e-18 } }