{ "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" [ [ 0.5419945 1.059703 1.497036 ] [ 0.5287309 2.297187 0.1799033 ] [ 1.173246 2.181689 2.79912 ] [ 2.288869 1.000101 0.1162968 ] [ 2.25753 0.9328521 1.885741 ] [ 2.965412 2.910996 0.3877363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.419945000000001e-11 1.059703e-10 1.497036e-10 ] [ 5.287309e-11 2.297187e-10 1.799033e-11 ] [ 1.173246e-10 2.181689e-10 2.79912e-10 ] [ 2.288869e-10 1.000101e-10 1.162968e-11 ] [ 2.25753e-10 9.328521e-11 1.885741e-10 ] [ 2.965412e-10 2.910996e-10 3.877363e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -60.3109678 -32.6919606 10.5129677 ] [ -45.2730233 37.0856841 -50.6815422 ] [ -11.5193349 30.7648436 62.7116563 ] [ 30.8354097 -25.6619727 -54.1313498 ] [ 54.8071274 -41.5574533 47.7336533 ] [ 31.4607889 32.0608588 -16.1453852 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.662882258698162e-08 -5.237829496143475e-08 1.684363106416555e-08 ] [ -7.253537948419366e-08 5.941781603139429e-08 -8.120078201892861e-08 ] [ -1.845600906394551e-08 4.929071315848851e-08 1.00475149575505e-07 ] [ 4.940377251412954e-08 -4.111501270354785e-08 -8.672798310190676e-08 ] [ 8.781069817348709e-08 -6.658238009724781e-08 7.647774334263277e-08 ] [ 5.040574044750415e-08 5.136715841212995e-08 -2.586775870125033e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 68.766272 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.101757132979737e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.5168936 1.6063444 1.6130252 ] [ 0.1436127 2.8507814 -0.2699099 ] [ 1.1957817 1.6533795 3.2238854 ] [ 3.4111565 0.884594 0.1827434 ] [ 3.0316431 0.4021715 2.4528931 ] [ 2.490482 2.9852573 -0.3368039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.168936e-11 1.6063444e-10 1.6130252e-10 ] [ 1.436127e-11 2.8507814e-10 -2.699099e-11 ] [ 1.1957817e-10 1.6533795e-10 3.2238854e-10 ] [ 3.4111565e-10 8.84594e-11 1.827434e-11 ] [ 3.0316431e-10 4.021715e-11 2.4528931e-10 ] [ 2.490482e-10 2.9852573e-10 -3.368039e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.7e-06 6.8e-06 7.3e-06 ] [ -1e-06 5.4e-06 -3.14e-05 ] [ -1.69e-05 -1.2e-05 5.7e-05 ] [ 1.49e-05 -1e-06 -2.77e-05 ] [ 8.9e-06 6e-07 1.7e-06 ] [ 3.8e-06 2e-07 -6.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.554111322176e-14 1.089480102144e-14 1.169588933184e-14 ] [ -1.6021766208e-15 8.65175375232e-15 -5.030834589312e-14 ] [ -2.707678489152e-14 -1.92261194496e-14 9.13240673856e-14 ] [ 2.387243164992e-14 -1.6021766208e-15 -4.438029239616e-14 ] [ 1.425937192512e-14 9.6130597248e-16 2.72370025536e-15 ] [ 6.08827115904e-15 3.2043532416e-16 -1.105501868352e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.889999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.225423166073538e-18 } }