{ "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" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4091729 -2.0680818 -0.7418937 ] [ -1.6699534 2.0486408 1.5120089 ] [ -0.740887 -0.3339093 0.4929373 ] [ 1.9707059 -0.1288128 -0.3752522 ] [ 1.8228324 -2.3802457 0.8191895 ] [ 0.1910281 -0.6011844 -4.6377773 ] [ 0.8354469 3.4635932 2.9307875 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.859920527646019e-09 -3.313432337160661e-09 -1.188644751051806e-09 ] [ -2.675560317348855e-09 3.282284421219067e-09 2.422505329980042e-09 ] [ -1.187031839834358e-09 -5.349816783352962e-10 7.897726240870482e-10 ] [ 3.15741894546594e-09 -2.063808583201152e-10 -6.012203066970948e-10 ] [ 2.920499478978141e-09 -3.813574043718974e-09 1.312486275718143e-09 ] [ 3.060607582574154e-10 -9.632035984053094e-10 -7.430538423755607e-09 ] [ 1.338533502127734e-09 5.549288094721288e-09 4.695639251719275e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.552166 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.132602350928924e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1090147 1.4164614 2.9133045 ] [ 2.0553151 3.2303935 4.4572369 ] [ 1.6833759 3.675742 2.1463444 ] [ 4.2185069 1.4709036 1.8044414 ] [ 4.1683907 2.1984324 4.0739593 ] [ 3.8038135 3.6720541 1.057224 ] [ 3.7427881 4.4577181 3.3070046 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1090147e-10 1.4164614e-10 2.9133045e-10 ] [ 2.0553151e-10 3.2303935e-10 4.4572369e-10 ] [ 1.6833759e-10 3.675742e-10 2.1463444e-10 ] [ 4.218506900000001e-10 1.4709036e-10 1.8044414e-10 ] [ 4.1683907e-10 2.1984324e-10 4.0739593e-10 ] [ 3.8038135e-10 3.6720541e-10 1.057224e-10 ] [ 3.7427881e-10 4.457718100000001e-10 3.3070046e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.97e-05 2.43e-05 2.61e-05 ] [ 6.1e-06 -1.64e-05 3.3e-06 ] [ -1.61e-05 9.4e-06 2.87e-05 ] [ 1.72e-05 -3.14e-05 -5.6e-06 ] [ 5.1e-06 4.7e-06 -1.44e-05 ] [ 5.75e-05 2.14e-05 -2.54e-05 ] [ -5.01e-05 -1.22e-05 -1.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.15628796898e-14 3.893289220619999e-14 4.18168101474e-14 ] [ 9.773277467399999e-15 -2.62756967976e-14 5.2871828922e-15 ] [ -2.579504380739999e-14 1.50604603596e-14 4.598246939579999e-14 ] [ 2.75574381048e-14 -5.030834630759999e-14 -8.972189150399999e-15 ] [ 8.1711008334e-15 7.530230179799999e-15 -2.30713435296e-14 ] [ 9.212515645499998e-14 3.42865799676e-14 -4.06952865036e-14 ] [ -8.026904936339999e-14 -1.95465549348e-14 -2.05078609152e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864829040116e-18 } }