{ "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" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9174772 -7.7458782 4.3960228 ] [ 1.8440819 -0.1955524 -5.3166783 ] [ -0.6761443 0.8127413 4.6226966 ] [ 4.3148567 9.0758273 -0.3314101 ] [ 1.0473384 0.7225027 0.0819895 ] [ -2.7917555 1.0404894 -2.3313394 ] [ -0.8209001 -3.7101301 -1.1212811 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.674313761557046e-09 -1.241026495960439e-08 7.043204954663754e-09 ] [ 2.954544907020443e-09 -3.133094834213299e-10 -8.51825767257469e-09 ] [ -1.083302589747181e-09 1.302155109618599e-09 7.40637641757165e-09 ] [ 6.913162526842239e-09 1.454107831447839e-08 -5.3097751411699e-10 ] [ 1.678021098546079e-09 1.157576934404876e-09 1.313616600510816e-10 ] [ -4.472885393089814e-09 1.66704779087022e-09 -3.7352174818299e-09 ] [ -1.315226948232382e-09 -5.944283706346366e-09 -1.796490363764907e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.326341 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.05772714406085e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7564052 0.582428 2.7039159 ] [ 1.3958389 2.4894341 2.7267808 ] [ 1.457324 2.6308997 5.0321067 ] [ 3.6068577 2.736792 2.1189844 ] [ 3.0650172 0.9401502 5.0195008 ] [ 4.837855 1.338253 3.537829 ] [ 3.66005 3.1867301 4.4386574 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7564052e-10 5.82428e-11 2.7039159e-10 ] [ 1.3958389e-10 2.4894341e-10 2.7267808e-10 ] [ 1.457324e-10 2.6308997e-10 5.0321067e-10 ] [ 3.6068577e-10 2.736792e-10 2.1189844e-10 ] [ 3.0650172e-10 9.401502000000001e-11 5.019500800000001e-10 ] [ 4.837855000000001e-10 1.338253e-10 3.537829e-10 ] [ 3.66005e-10 3.1867301e-10 4.4386574e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 -3.9e-05 -2.47e-05 ] [ -1.43e-05 -2.34e-05 2.03e-05 ] [ 5.7e-05 3.66e-05 3.85e-05 ] [ 3.57e-05 3.3e-06 -2.17e-05 ] [ -3.35e-05 7.8e-06 -5.1e-05 ] [ 5.2e-06 2.56e-05 2.7e-05 ] [ -4.83e-05 -1.09e-05 1.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 -6.248488821120001e-14 -3.957376253376001e-14 ] [ -2.291112567744e-14 -3.749093292672001e-14 3.252418540224e-14 ] [ 9.13240673856e-14 5.863966432128e-14 6.16837999008e-14 ] [ 5.719770536256001e-14 5.28718284864e-15 -3.476723267136e-14 ] [ -5.36729167968e-14 1.249697764224e-14 -8.17110076608e-14 ] [ 8.33131842816e-15 4.101572149248001e-14 4.32587687616e-14 ] [ -7.738513078464e-14 -1.746372516672e-14 1.84250311392e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.337723 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.860639051890644e-18 } }