{ "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" [ [ -9.7102613 -6.6949194 -34.696783 ] [ -14.3967212 5.2404868 28.1002972 ] [ -13.6390931 0.0597028 -7.603298 ] [ -5.3540132 -98.4781337 -104.9356426 ] [ 29.722878 96.5782086 112.4050385 ] [ 13.3772108 3.294655 6.7303879 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.555755363671902e-08 -1.072644334082036e-08 -5.55903745395709e-08 ] [ -2.306609012281572e-08 8.396185432571007e-09 4.50216392113717e-08 ] [ -2.18522360937346e-08 9.565443035629825e-11 -1.21818262965754e-08 ] [ -8.578074776494596e-09 -1.577793634741566e-07 -1.681254332623445e-07 ] [ 4.762130023449067e-08 1.547353478976655e-07 1.800927247448239e-07 ] [ 2.143265439527326e-08 5.278619214601824e-09 1.078327014229521e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 45.596192 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.3053152819908e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.065309 0.3880254 0.6220258 ] [ -0.0870061 0.6070968 3.0243743 ] [ 0.4718086 2.6186536 -0.0232863 ] [ 2.2992423 -0.3707956 1.1475958 ] [ 2.2197831 1.3141776 2.8787807 ] [ 2.0220252 3.2850486 1.6005293 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.530900000000001e-12 3.880254e-11 6.220257999999999e-11 ] [ -8.700610000000001e-12 6.070968e-11 3.0243743e-10 ] [ 4.718086e-11 2.6186536e-10 -2.32863e-12 ] [ 2.2992423e-10 -3.707956e-11 1.1475958e-10 ] [ 2.2197831e-10 1.3141776e-10 2.8787807e-10 ] [ 2.0220252e-10 3.2850486e-10 1.6005293e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.04e-05 1.53e-05 1.75e-05 ] [ -5.67e-05 -6.3e-05 3.29e-05 ] [ 6.5e-06 -1.02e-05 -2.04e-05 ] [ -1.98e-05 -1.23e-05 -3.74e-05 ] [ 1.76e-05 5.37e-05 1.3e-05 ] [ 3.2e-05 1.67e-05 -5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.268440306432e-14 2.451330229824e-14 2.8038090864e-14 ] [ -9.084341439936e-14 -1.009371271104e-13 5.271161082432e-14 ] [ 1.04141480352e-14 -1.634220153216e-14 -3.268440306432e-14 ] [ -3.172309709184e-14 -1.970677243584e-14 -5.992140561792e-14 ] [ 2.819830852608e-14 8.603688453696e-14 2.08282960704e-14 ] [ 5.12696518656e-14 2.675634956736e-14 -8.8119714144e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.824992 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.375225558594703e-18 } }