{ "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" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.8285583 -9.4282051 -1.02435 ] [ 0.8289955 2.221106 -6.8195598 ] [ -7.3532156 5.3772672 4.6136506 ] [ 0.8265535 -3.1025209 -0.6014986 ] [ 1.9938207 -2.038981 0.013322 ] [ 9.6122696 7.9990294 -4.7826834 ] [ 2.9201345 -1.0276956 8.6011193 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.414490982016676e-08 -1.510564991177963e-08 -1.6411896350379e-09 ] [ 1.328197219791147e-09 3.558604134837203e-09 -1.092613936572571e-08 ] [ -1.178115021908429e-08 8.615331862614606e-09 7.391883188760079e-09 ] [ 1.324284704450919e-09 -4.97078649247665e-09 -9.637070023037123e-10 ] [ 3.194452937925523e-09 -3.266807715369954e-09 2.1344197118148e-11 ] [ 1.540055375282852e-08 1.281585799935904e-08 -7.662703591299675e-09 ] [ 4.678571264037273e-09 -1.64654987718461e-09 1.378051236870644e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.2682852 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.324725335068802e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9732695 2.1109942 3.3908845 ] [ 3.3594041 4.0727063 1.1053919 ] [ 1.1795129 4.2959885 2.3969637 ] [ 3.360709 1.6422235 1.3948853 ] [ 5.4710072 1.5257934 2.7928685 ] [ 4.7597642 4.5148543 2.9562078 ] [ 3.9796201 2.8630929 4.4886814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9732695e-10 2.1109942e-10 3.3908845e-10 ] [ 3.3594041e-10 4.0727063e-10 1.1053919e-10 ] [ 1.1795129e-10 4.2959885e-10 2.3969637e-10 ] [ 3.360709e-10 1.6422235e-10 1.3948853e-10 ] [ 5.4710072e-10 1.5257934e-10 2.7928685e-10 ] [ 4.7597642e-10 4.5148543e-10 2.9562078e-10 ] [ 3.9796201e-10 2.8630929e-10 4.4886814e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.02e-05 2.6e-06 4.34e-05 ] [ 3.12e-05 6.3e-06 -7.7e-06 ] [ 1.03e-05 1.99e-05 -1.92e-05 ] [ 2.6e-06 -4.77e-05 -7.7e-06 ] [ 4.4e-06 5.52e-05 -5.99e-05 ] [ 3.4e-06 1.23e-05 -3.05e-05 ] [ -4.18e-05 -4.85e-05 8.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.63422016668e-14 4.165659248399999e-15 6.953446591559999e-14 ] [ 4.998791098079999e-14 1.00937127942e-14 -1.23367600818e-14 ] [ 1.65024193302e-14 3.18833150166e-14 -3.076179137279999e-14 ] [ 4.165659248399999e-15 -7.64238254418e-14 -1.23367600818e-14 ] [ 7.0495771896e-15 8.844015019679999e-14 -9.597038037659999e-14 ] [ 5.4474005556e-15 1.97067725982e-14 -4.886638733699999e-14 ] [ -6.697098330119999e-14 -7.770556674899999e-14 1.307376133344e-13 ] ] } "relaxed-potential-energy" { "source-value" -18.891963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.026826168899254e-18 } }