{ "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" [ [ 0.8494568 1.09498 0.2360667 ] [ 0.557157 2.835915 1.114432 ] [ 0.135541 1.869398 2.917972 ] [ 1.620291 0.3348641 1.837353 ] [ 2.814436 1.836887 0.4161362 ] [ 2.451507 2.913738 2.050042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.494568e-11 1.09498e-10 2.360667e-11 ] [ 5.57157e-11 2.835915e-10 1.114432e-10 ] [ 1.35541e-11 1.869398e-10 2.917972e-10 ] [ 1.620291e-10 3.348641e-11 1.837353e-10 ] [ 2.814436e-10 1.836887e-10 4.161362e-11 ] [ 2.451507e-10 2.913738e-10 2.050042e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9506209 -3.7201659 -10.4433609 ] [ -2.8239459 7.4995804 -0.6527511 ] [ -0.1031104 -1.2671314 2.2633135 ] [ 3.3286036 -3.6089879 7.2735397 ] [ 3.5650377 -2.1469105 -4.628061 ] [ 0.9840358 3.2436154 6.1873198 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.931769064423854e-09 -5.960362830477391e-09 -1.673210867655685e-08 ] [ -4.524460099384015e-09 1.201565238268991e-08 -1.045822551621483e-09 ] [ -1.652010722413363e-10 -2.030168304561573e-09 3.626227975241021e-09 ] [ 5.333010867830716e-09 -5.782236038130088e-09 1.165349525780065e-08 ] [ 5.711820055210604e-09 -3.439729810050038e-09 -7.414971133836269e-09 ] [ 1.576599152790225e-09 5.196844760746841e-09 9.913179128972932e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.818685 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.053779741639965e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8548036 1.2069561 -0.2031653 ] [ 0.0900363 3.0379961 1.0995782 ] [ 0.6870633 1.8590579 3.1070924 ] [ 1.4518201 0.0280136 1.8043478 ] [ 3.0547149 1.461355 0.7307069 ] [ 2.2899505 3.2924033 2.0334418 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.548036e-11 1.2069561e-10 -2.031653e-11 ] [ 9.00363e-12 3.0379961e-10 1.0995782e-10 ] [ 6.870633e-11 1.8590579e-10 3.1070924e-10 ] [ 1.4518201e-10 2.80136e-12 1.8043478e-10 ] [ 3.0547149e-10 1.461355e-10 7.307069000000001e-11 ] [ 2.2899505e-10 3.2924033e-10 2.0334418e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-06 -5.4e-06 -4e-06 ] [ 5.2e-06 5e-06 1.7e-06 ] [ -3.8e-06 3.4e-06 -6.6e-06 ] [ 5.3e-06 -1e-06 7.6e-06 ] [ 1e-06 6.7e-06 -5.6e-06 ] [ -1.8e-06 -8.6e-06 6.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6130597248e-15 -8.65175375232e-15 -6.4087064832e-15 ] [ 8.33131842816e-15 8.010883104e-15 2.72370025536e-15 ] [ -6.08827115904e-15 5.44740051072e-15 -1.057436569728e-14 ] [ 8.491536090240001e-15 -1.6021766208e-15 1.217654231808e-14 ] [ 1.6021766208e-15 1.073458335936e-14 -8.972189076479999e-15 ] [ -2.88391791744e-15 -1.377871893888e-14 1.089480102144e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.513765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806014482518531e-18 } }