{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 9.299337e-11 -5.75574e-12 2.3035056e-10 ] [ 3.1238719e-10 3.2527564e-10 3.0387228e-10 ] [ 6.201922e-11 2.7447432e-10 1.7037975e-10 ] [ 2.2032412e-10 1.0220942e-10 4.7379857e-10 ] [ 3.78101e-10 6.027484e-11 1.9140663e-10 ] ] "source-value" [ [ 0.9299337 -0.0575574 2.3035056 ] [ 3.1238719 3.2527564 3.0387228 ] [ 0.6201922 2.7447432 1.7037975 ] [ 2.2032412 1.0220942 4.7379857 ] [ 3.78101 0.6027484 1.9140663 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.859885268128e-12 7.594317182591999e-13 -1.79748195087552e-12 ] [ 1.00264212929664e-12 1.9137999735456e-12 -5.92116413749056e-12 ] [ 1.68212523417792e-12 -2.50692575856576e-12 6.50211338019264e-12 ] [ -4.0751362350048e-12 -1.22854903282944e-12 1.9770859500672e-13 ] [ 4.250254139658239e-12 1.0622430995904e-12 1.0189843308288e-12 ] ] "source-value" [ [ -0.001785 0.000474 -0.0011219 ] [ 0.0006258 0.0011945 -0.0036957 ] [ 0.0010499 -0.0015647 0.0040583 ] [ -0.0025435 -0.0007668 0.0001234 ] [ 0.0026528 0.000663 0.000636 ] ] } "species" { "source-value" [ "Si" "Si" "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" -1.943991389787955e-18 "source-value" -12.13344 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.194415552995248e-08 -6.06941208223246e-08 4.334147472094232e-09 ] [ 1.365245107895943e-08 3.634524173957653e-08 1.561994752129815e-08 ] [ -1.194149820127878e-08 3.623590904675547e-08 -1.52979013687636e-08 ] [ -2.733978202360666e-08 9.972059280004994e-09 5.91396030279399e-08 ] [ 4.757298483609616e-08 -2.185908940423007e-08 -6.379579665256867e-08 ] ] "source-value" [ [ -13.6964647 -37.8822909 2.7051621 ] [ 8.5211898 22.6849158 9.7492045 ] [ -7.453297 22.6166757 -9.5481991 ] [ -17.0641499 6.2240699 36.9120372 ] [ 29.6927219 -13.6433706 -39.8182047 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.010089666932046e-18 "source-value" 12.545993 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.063375e-10 5.708417e-11 2.359419e-10 ] [ 2.68579e-10 2.886891e-10 2.868985e-10 ] [ 6.763911e-11 2.686272e-10 1.583941e-10 ] [ 2.607368e-10 7.750333e-11 4.497523e-10 ] [ 3.625325e-10 6.457468e-11 2.38821e-10 ] ] "source-value" [ [ 1.063375 0.5708417 2.359419 ] [ 2.68579 2.886891 2.868985 ] [ 0.6763911 2.686272 1.583941 ] [ 2.607368 0.7750333 4.497523 ] [ 3.625325 0.6457468 2.38821 ] ] } "instance-id" 1 }