{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.604026 -3.0848862 -1.211781 ] [ -1.6801222 -0.882873 3.119027 ] [ -4.4938101 5.3200502 -6.0934853 ] [ -0.1783631 3.7446064 2.109971 ] [ 1.4863257 -2.3988981 -2.4095605 ] [ 5.4869654 -4.204304 5.3424345 ] [ 1.9830303 1.5063047 -0.8566056 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.172109577155341e-09 -4.942532547468553e-09 -1.941487187729645e-09 ] [ -2.691852508927062e-09 -1.414518479735558e-09 4.997232139043962e-09 ] [ -7.199877480534911e-09 8.523660051922365e-09 -9.762839686848475e-09 ] [ -2.857691888334125e-10 5.999520828178053e-09 3.380546206765997e-09 ] [ 2.381356287434195e-09 -3.84345845150154e-09 -3.860541499503158e-09 ] [ 8.79108768301852e-09 -6.736037575535923e-09 8.559523654055339e-09 ] [ 3.17716478499801e-09 2.413366174141158e-09 -1.372433465566357e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.602954 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.019215825181785e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1117145 1.5974727 1.3732885 ] [ 2.9641685 3.0186426 5.5373643 ] [ 1.1036998 3.5820469 2.2971266 ] [ 2.8175133 4.4628453 3.6694641 ] [ 4.2727103 1.5979125 2.3357728 ] [ 3.972211 1.0340917 4.6135068 ] [ 4.7680357 3.9074303 2.452934 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1117145e-10 1.5974727e-10 1.3732885e-10 ] [ 2.9641685e-10 3.0186426e-10 5.5373643e-10 ] [ 1.1036998e-10 3.5820469e-10 2.2971266e-10 ] [ 2.8175133e-10 4.4628453e-10 3.6694641e-10 ] [ 4.2727103e-10 1.5979125e-10 2.3357728e-10 ] [ 3.972211e-10 1.0340917e-10 4.6135068e-10 ] [ 4.7680357e-10 3.9074303e-10 2.452934e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.7e-06 1.99e-05 -2.26e-05 ] [ 2.36e-05 5.4e-06 -9.2e-06 ] [ -2.1e-06 -1.17e-05 -2.3e-06 ] [ -2e-07 -2.16e-05 -6e-06 ] [ -3.05e-05 -1.81e-05 7.9e-06 ] [ -5e-07 -8.5e-06 2.97e-05 ] [ 3.9e-06 3.47e-05 2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.13240673856e-15 3.188331475392e-14 -3.620919163008e-14 ] [ 3.781136825088e-14 8.65175375232e-15 -1.474002491136e-14 ] [ -3.36457090368e-15 -1.874546646336e-14 -3.68500622784e-15 ] [ -3.2043532416e-16 -3.460701500928e-14 -9.6130597248e-15 ] [ -4.88663869344e-14 -2.899939683648e-14 1.265719530432e-14 ] [ -8.010883104e-16 -1.36185012768e-14 4.758464563776e-14 ] [ 6.24848882112e-15 5.559552874176001e-14 4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }