{ "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" [ [ 1.466656 0.07552 0.8362243 ] [ 0.0979932 0.4288587 1.191786 ] [ 0.4994915 2.11153 0.6404272 ] [ 2.455877 2.004038 2.378996 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.466656e-10 7.552e-12 8.362243000000001e-11 ] [ 9.799320000000001e-12 4.288587e-11 1.191786e-10 ] [ 4.994915e-11 2.11153e-10 6.404272e-11 ] [ 2.455877e-10 2.004038e-10 2.378996e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 50.0357309 -12.8333421 -11.3386461 ] [ -50.4092511 0.0614089 17.6282519 ] [ 3.6015731 14.9532255 -3.4451378 ] [ -3.2280529 -2.1812923 -2.844468 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.016607825262013e-08 -2.056128067934838e-08 -1.81665136929451e-08 ] [ -8.076452358445669e-08 9.838790388904512e-11 2.824357305975318e-08 ] [ 5.770356218922181e-09 2.395770830165039e-08 -5.519719238594346e-09 ] [ -5.171910887085641e-09 -3.49481552619106e-09 -4.557340128213735e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 5.8472216 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.36828174415677e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9436875 0.1657436 0.5186866 ] [ -0.0970242 0.5014225 1.7719922 ] [ 0.75751 2.2669272 0.3575229 ] [ 1.9158444 1.6858535 2.3992319 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9436875e-10 1.657436e-11 5.186866e-11 ] [ -9.70242e-12 5.014225e-11 1.7719922e-10 ] [ 7.5751e-11 2.2669272e-10 3.575229e-11 ] [ 1.9158444e-10 1.6858535e-10 2.3992319e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-06 1.24e-05 4.2e-06 ] [ -1.56e-05 -1e-05 -8.8e-06 ] [ 7e-06 -1.22e-05 6.5e-06 ] [ 1.65e-05 9.8e-06 -1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.28174129664e-14 1.986699009792e-14 6.72914180736e-15 ] [ -2.499395528448e-14 -1.6021766208e-14 -1.409915426304e-14 ] [ 1.12152363456e-14 -1.954655477376e-14 1.04141480352e-14 ] [ 2.64359142432e-14 1.570133088384e-14 -2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.299968 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.970672116618813e-18 } }