{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 6.134935e-11 -2.485548e-11 1.6534158e-10 ] [ 2.884345e-11 3.1486725e-10 -1.060242e-11 ] [ 1.2054726e-10 2.0254331e-10 1.745386e-10 ] ] "source-value" [ [ 0.6134935 -0.2485548 1.6534158 ] [ 0.2884345 3.1486725 -0.1060242 ] [ 1.2054726 2.0254331 1.745386 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.4078296724416e-13 -1.82375764745664e-12 1.20531747182784e-12 ] [ 5.936064380064e-13 1.2953597979168e-12 4.5453750732096e-13 ] [ -9.3438940525056e-13 5.2855806720192e-13 -1.6598549791488e-12 ] ] "source-value" [ [ 0.0002127 -0.0011383 0.0007523 ] [ 0.0003705 0.0008085 0.0002837 ] [ -0.0005832 0.0003299 -0.001036 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -7.418076632780366e-19 "source-value" -4.6299993 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.290870138252552e-09 -1.833383332333212e-08 1.582655861069835e-09 ] [ -4.268966601283211e-09 1.042626962285999e-08 -1.053043305303169e-08 ] [ 7.559836739535763e-09 7.907563700472132e-09 8.947777191961856e-09 ] ] "source-value" [ [ -2.0539996 -11.4430788 0.9878161 ] [ -2.6644794 6.5075657 -6.5725794 ] [ 4.718479 4.9355131 5.5847633 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.245004332009262e-19 "source-value" -0.77707059 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.238256e-11 2.657078e-11 1.323619e-10 ] [ 2.50812e-11 2.60407e-10 3.529652e-12 ] [ 1.332763e-10 2.055773e-10 1.933862e-10 ] ] "source-value" [ [ 0.5238256 0.2657078 1.323619 ] [ 0.250812 2.60407 0.03529652 ] [ 1.332763 2.055773 1.933862 ] ] } "instance-id" 1 }