{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.107106e-10 9.293277e-11 1.9294951e-10 ] [ 1.8916153e-10 2.4065836e-10 3.4168643e-10 ] [ 1.4802721e-10 4.2321938e-10 1.8311207e-10 ] [ 3.1557896e-10 4.5212479e-10 3.7076452e-10 ] [ 4.4201185e-10 2.4552297e-10 3.3100347e-10 ] [ 3.5063672e-10 5.561191000000001e-10 1.5462316e-10 ] [ 3.6183222e-10 3.1587909e-10 1.0195139e-10 ] ] "source-value" [ [ 3.107106 0.9293277 1.9294951 ] [ 1.8916153 2.4065836 3.4168643 ] [ 1.4802721 4.2321938 1.8311207 ] [ 3.1557896 4.5212479 3.7076452 ] [ 4.4201185 2.4552297 3.3100347 ] [ 3.5063672 5.561191 1.5462316 ] [ 3.6183222 3.1587909 1.0195139 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 6.850907230540801e-12 2.371221398784e-12 1.55074675127232e-12 ] [ 2.02266787492896e-11 9.36215886598272e-12 -2.163867700520064e-11 ] [ -2.60578005606912e-12 2.07818329483968e-12 1.95721895996928e-12 ] [ 8.947034903533442e-12 -3.660781317333504e-11 -6.29631379325088e-11 ] [ -1.120994916275136e-11 1.026947148634176e-11 -7.61706809060736e-12 ] [ 7.08466479951552e-12 -4.16854313199744e-12 6.12496100365632e-12 ] [ -2.929371668172096e-11 1.669516104172224e-11 8.258611653108096e-11 ] ] "source-value" [ [ 0.004276 0.00148 0.0009679 ] [ 0.0126245 0.0058434 -0.0135058 ] [ -0.0016264 0.0012971 0.0012216 ] [ 0.0055843 -0.0228488 -0.0392985 ] [ -0.0069967 0.0064097 -0.0047542 ] [ 0.0044219 -0.0026018 0.0038229 ] [ -0.0182837 0.0104203 0.0515462 ] ] } "species" { "source-value" [ "Si" "Si" "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" -3.530342831451327e-18 "source-value" -22.034667 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.626598218089366e-09 3.48040522922826e-09 2.554753774832219e-09 ] [ -3.892039170344452e-09 -1.155107339361575e-08 -8.154305148564155e-10 ] [ -1.158865789365713e-08 -3.078849619927549e-09 -9.028603317474989e-10 ] [ 7.317137102405035e-09 1.069045316673435e-08 4.534206940856652e-09 ] [ -5.958513438004002e-09 -3.704125001456007e-10 -2.691102369833204e-09 ] [ 6.365606970794508e-09 3.796200649894424e-09 3.071709039163968e-11 ] [ 3.129868370934332e-09 -2.966723692385792e-09 -2.710284429425731e-09 ] ] "source-value" [ [ 2.8876955 2.1722981 1.5945519 ] [ -2.4292198 -7.209613 -0.5089517 ] [ -7.2330714 -1.9216668 -0.5635211 ] [ 4.5669978 6.6724561 2.8300294 ] [ -3.7190116 -0.2311933 -1.679654 ] [ 3.9730994 2.3694021 0.0191721 ] [ 1.9535102 -1.8516833 -1.6916265 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.822661257826305e-18 "source-value" -17.617666 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] "source-value" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] } "instance-id" 1 }