{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.91343 2.805447 1.311156 ] [ 2.653002 2.505168 3.277079 ] [ 1.829519 4.618852 2.376516 ] [ 4.982305 1.900488 2.423676 ] [ 4.143762 3.996307 2.985709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91343e-10 2.805447e-10 1.311156e-10 ] [ 2.653002e-10 2.505168e-10 3.277079e-10 ] [ 1.829519e-10 4.618852000000001e-10 2.376516e-10 ] [ 4.982305e-10 1.900488e-10 2.423676e-10 ] [ 4.143762e-10 3.996307e-10 2.985709e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0532274 5.5676208 -31.9325338 ] [ -14.4338379 -29.3072753 39.5853625 ] [ -9.388253 13.4999527 -8.6808276 ] [ 7.5647629 -5.3900629 -1.5970301 ] [ 17.3105554 15.6297647 2.6250291 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.68745631666597e-09 8.920311879239792e-09 -5.116155909726579e-08 ] [ -2.312555763179697e-08 -4.695543130500931e-08 6.342274232339304e-08 ] [ -1.504163946675546e-08 2.162930859784584e-08 -1.390821902991537e-08 ] [ 1.212008626027521e-08 -8.635832763021448e-09 -2.558724288933886e-09 ] [ 2.773456715494319e-08 2.504164359094513e-08 4.205760252939665e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.8380766 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.944923355759554e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.0412293 2.8714629 0.8787214 ] [ 2.511369 2.2846576 3.6144656 ] [ 1.7303584 4.5813412 2.473703 ] [ 4.8784482 1.749164 2.4759422 ] [ 4.3606131 4.3396363 2.9313038 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0412293e-10 2.8714629e-10 8.787214e-11 ] [ 2.511369e-10 2.2846576e-10 3.6144656e-10 ] [ 1.7303584e-10 4.5813412e-10 2.473703e-10 ] [ 4.8784482e-10 1.749164e-10 2.4759422e-10 ] [ 4.3606131e-10 4.3396363e-10 2.9313038e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.4e-06 3.8e-06 1.38e-05 ] [ -1.96e-05 1.3e-06 -8.8e-06 ] [ -9.3e-06 6.4e-06 1.35e-05 ] [ 2.3e-05 -1.83e-05 1e-06 ] [ -2.5e-06 6.7e-06 -1.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.345828361472e-14 6.08827115904e-15 2.211003736704e-14 ] [ -3.140266176767999e-14 2.08282960704e-15 -1.409915426304e-14 ] [ -1.490024257344e-14 1.025393037312e-14 2.16293843808e-14 ] [ 3.68500622784e-14 -2.931983216064e-14 1.6021766208e-15 ] [ -4.005441552e-15 1.073458335936e-14 -3.108222644352e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.907624 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.548682326527698e-18 } }