{ "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" [ [ 0.2482594 0.208506 0.7144033 ] [ 0.1842271 0.5542422 2.415306 ] [ 0.3347056 2.949491 0.3757933 ] [ 2.042519 0.2544893 1.784175 ] [ 2.203059 1.053322 2.694572 ] [ 1.978392 2.822156 1.26577 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.482594e-11 2.08506e-11 7.144033e-11 ] [ 1.842271e-11 5.542422e-11 2.415306e-10 ] [ 3.347056e-11 2.949491e-10 3.757933e-11 ] [ 2.042519e-10 2.544893e-11 1.784175e-10 ] [ 2.203059e-10 1.053322e-10 2.694572e-10 ] [ 1.978392e-10 2.822156e-10 1.26577e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6780577 -1.9199146 -18.2111889 ] [ -14.5644707 1.9238238 14.6571412 ] [ -5.697965 -1.6847873 -2.6641454 ] [ 2.4958239 -61.2162189 -65.7581283 ] [ 19.1009337 59.9315666 70.2141677 ] [ 6.3437359 2.9655304 1.7621537 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.230160454009342e-08 -3.076042286052583e-09 -2.917754109255247e-08 ] [ -2.333485444986661e-08 3.082305514898615e-09 2.348332895840446e-08 ] [ -9.129146309136672e-09 -2.699326823080756e-09 -4.268431474291864e-09 ] [ 3.998750702213877e-09 -9.80791947353551e-08 -1.053561357898268e-07 ] [ 3.060306940959084e-08 9.602095485443813e-08 1.124954979378705e-07 ] [ 1.016378534750965e-08 4.751303475151673e-09 2.823281460396217e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 21.014395 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.366877236925642e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2826828 0.1044869 0.5080175 ] [ -0.2446119 1.1177092 2.6685437 ] [ 0.1183138 2.5344276 0.7105308 ] [ 2.5088197 0.2141573 0.9999353 ] [ 1.9815168 1.2273472 3.1604994 ] [ 2.344441 2.6440783 1.202493 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.826828e-11 1.044869e-11 5.080175e-11 ] [ -2.446119e-11 1.1177092e-10 2.6685437e-10 ] [ 1.183138e-11 2.5344276e-10 7.105308000000001e-11 ] [ 2.5088197e-10 2.141573e-11 9.999353e-11 ] [ 1.9815168e-10 1.2273472e-10 3.1604994e-10 ] [ 2.344441e-10 2.6440783e-10 1.202493e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.95e-05 1.4e-06 -3.75e-05 ] [ -1.71e-05 9.6e-06 4.57e-05 ] [ -5.9e-06 8.6e-06 4.4e-06 ] [ 4e-07 -2.26e-05 1.66e-05 ] [ 3.2e-06 8.6e-06 -3.23e-05 ] [ -1.01e-05 -5.7e-06 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.72642103136e-14 2.24304726912e-15 -6.008162327999999e-14 ] [ -2.739722021568e-14 1.538089555968e-14 7.321947157056e-14 ] [ -9.45284206272e-15 1.377871893888e-14 7.04957713152e-15 ] [ 6.408706483200001e-16 -3.620919163008e-14 2.659613190528e-14 ] [ 5.126965186560001e-15 1.377871893888e-14 -5.175030485184e-14 ] [ -1.618198387008e-14 -9.13240673856e-15 4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.567729 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853354495955016e-18 } }