{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3005559 0.7108859 0.0877427 ] [ -0.2443379 1.5966416 0.8198454 ] [ 1.6361013 -2.0012967 3.2538704 ] [ 0.8878761 0.7033691 -2.6119701 ] [ -1.9790837 -1.0095999 -1.5494884 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.815436401908406e-10 1.13896477842006e-09 1.405793037440718e-10 ] [ -3.914724741806285e-10 2.558101864392374e-09 1.313537143372383e-09 ] [ 2.621323273717024e-09 -3.206430810441308e-09 5.213275124944233e-09 ] [ 1.422534341307047e-09 1.126921537097609e-09 -4.184837462926644e-09 ] [ -3.170841660870265e-09 -1.617557369468736e-09 -2.482554109134045e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.494001 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.642630300337263e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.462305 2.7022369 3.1265279 ] [ 2.6629102 4.6713232 1.5227177 ] [ 4.3775232 2.7887541 1.446949 ] [ 4.7903052 1.9230449 3.8070019 ] [ 4.3399394 4.4005359 3.4211244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.462305e-10 2.7022369e-10 3.1265279e-10 ] [ 2.6629102e-10 4.6713232e-10 1.5227177e-10 ] [ 4.3775232e-10 2.7887541e-10 1.446949e-10 ] [ 4.7903052e-10 1.9230449e-10 3.8070019e-10 ] [ 4.3399394e-10 4.400535900000001e-10 3.4211244e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.57e-05 -4.04e-05 2.4e-06 ] [ 2.04e-05 -9.37e-05 6.19e-05 ] [ 8.9e-06 0.0001334 8.63e-05 ] [ -0.0001284 2.33e-05 -2.5e-05 ] [ 6.34e-05 -2.25e-05 -0.0001256 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.719770583379999e-14 -6.472793601359999e-14 3.845223921599999e-15 ] [ 3.26844033336e-14 -1.501239506058e-13 9.917473364459999e-14 ] [ 1.42593720426e-14 2.137303629756e-13 1.382678435142e-13 ] [ -2.057194798056e-13 3.733071557219999e-14 -4.005441585e-14 ] [ 1.015779985956e-13 -3.6048974265e-14 -2.012333852303999e-13 ] ] } "relaxed-potential-energy" { "source-value" -17.756113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.844842935926364e-18 } }