{ "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" [ [ -8.8285586 -9.4282047 -1.0243498 ] [ 0.8289954 2.2211063 -6.81956 ] [ -7.3532158 5.3772668 4.6136506 ] [ 0.8265538 -3.1025212 -0.6014986 ] [ 1.9938209 -2.0389813 0.0133218 ] [ 9.6122698 7.9990294 -4.7826835 ] [ 2.9201345 -1.0276953 8.6011195 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.414491030081975e-08 -1.510564927090898e-08 -1.641189314602573e-09 ] [ 1.328197059573484e-09 3.558604615490194e-09 -1.092613968616104e-08 ] [ -1.178115053951962e-08 8.61533122174395e-09 7.391883188760079e-09 ] [ 1.324285185103909e-09 -4.97078697312964e-09 -9.637070023037123e-10 ] [ 3.19445325836085e-09 -3.266808196022944e-09 2.13438766828212e-11 ] [ 1.540055407326385e-08 1.281585799935904e-08 -7.662703751517338e-09 ] [ 4.678571264037273e-09 -1.64654939653162e-09 1.378051268914176e-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" [ [ 1.9732707 2.1109647 3.390864 ] [ 3.3594082 4.0727347 1.1054133 ] [ 1.1795087 4.2959782 2.396978 ] [ 3.3607252 1.6422438 1.3948567 ] [ 5.4710231 1.5258226 2.7928272 ] [ 4.7597366 4.5148684 2.9562597 ] [ 3.9796144 2.8630407 4.4886843 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9732707e-10 2.1109647e-10 3.390864e-10 ] [ 3.3594082e-10 4.0727347e-10 1.1054133e-10 ] [ 1.1795087e-10 4.295978200000001e-10 2.396978e-10 ] [ 3.3607252e-10 1.6422438e-10 1.3948567e-10 ] [ 5.471023100000001e-10 1.5258226e-10 2.7928272e-10 ] [ 4.7597366e-10 4.5148684e-10 2.9562597e-10 ] [ 3.9796144e-10 2.8630407e-10 4.4886843e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.9e-06 -6e-07 -7.1e-06 ] [ -4.2e-06 4.5e-06 2e-07 ] [ 4.7e-06 -6.1e-06 -8.7e-06 ] [ -1.81e-05 -3.1e-06 -3.2e-06 ] [ -4.1e-06 6.5e-06 9.7e-06 ] [ 3.3e-06 4.9e-06 3.1e-06 ] [ 1.36e-05 -6.2e-06 6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.850665506599998e-15 -9.613059803999998e-16 -1.13754541014e-14 ] [ -6.729141862799999e-15 7.209794853e-15 3.204353268e-16 ] [ 7.530230179799999e-15 -9.773277467399999e-15 -1.39389367158e-14 ] [ -2.899939707539999e-14 -4.9667475654e-15 -5.1269652288e-15 ] [ -6.568924199399999e-15 1.0414148121e-14 1.55411133498e-14 ] [ 5.2871828922e-15 7.850665506599998e-15 4.9667475654e-15 ] [ 2.17896022224e-14 -9.9334951308e-15 9.613059803999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.891963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.026826168899254e-18 } }