{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1032294 0.9160098 0.6340424 ] [ 0.5975465 2.782152 1.021804 ] [ 1.919093 1.0464 1.488365 ] [ 2.284896 2.976774 2.795304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032294e-11 9.160098e-11 6.340424e-11 ] [ 5.975465e-11 2.782152e-10 1.021804e-10 ] [ 1.919093e-10 1.0464e-10 1.488365e-10 ] [ 2.284896e-10 2.976774e-10 2.795304e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.8357097 -8.472224 -5.5515838 ] [ -13.3077079 22.7187765 -6.158278 ] [ 18.5709718 -18.7562107 5.2357088 ] [ 4.5724459 4.5096582 6.4741531 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.575854413031578e-08 -1.357399921898066e-08 -8.894617772772025e-09 ] [ -2.132129847381547e-08 3.639949256148046e-08 -9.866649035986983e-09 ] [ 2.975397684349609e-08 -3.00507622783388e-08 8.388530232676824e-09 ] [ 7.325865920852815e-09 7.22526893583901e-09 1.037273673629984e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.4775714 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.969506973442725e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0570614 0.8007694 0.3562081 ] [ 0.4424349 3.0017984 1.2244197 ] [ 2.0099699 0.8588781 1.7453073 ] [ 2.3952988 3.0598899 2.6135803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.70614e-12 8.007694e-11 3.562081e-11 ] [ 4.424349000000001e-11 3.001798400000001e-10 1.2244197e-10 ] [ 2.0099699e-10 8.588781e-11 1.7453073e-10 ] [ 2.3952988e-10 3.0598899e-10 2.6135803e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 9.4e-06 -1.04e-05 ] [ -9.27e-05 8.27e-05 -2.93e-05 ] [ 6.81e-05 -9.75e-05 3.49e-05 ] [ 2.4e-05 5.3e-06 4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-15 1.506046023552e-14 -1.666263685632e-14 ] [ -1.4852177274816e-13 1.3250000654016e-13 -4.694377498944e-14 ] [ 1.0910822787648e-13 -1.56212220528e-13 5.591596406592e-14 ] [ 3.84522388992e-14 8.491536090240001e-15 7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.092646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.937455470481064e-18 } }