{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.0935321 -48.8704297 -8.6068116 ] [ -47.3538249 10.9819178 -36.5751387 ] [ -14.142369 65.4687501 41.084397 ] [ 45.7657099 -42.1381057 34.4228459 ] [ 25.8240161 14.5578676 -30.3252926 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.617162128514895e-08 -7.829906055887963e-08 -1.378963243876015e-08 ] [ -7.586919178530737e-08 1.759497209566868e-08 -5.859983261044913e-08 ] [ -2.265857316120594e-08 1.048925016674051e-07 6.582446089537969e-08 ] [ 7.332475104020246e-08 -6.75126883535622e-08 5.51514793767627e-08 ] [ 4.13746351914598e-08 2.332427530958565e-08 -4.85864752229331e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 47.550886 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.618491847519771e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0048069 -0.1436895 1.3918491 ] [ -0.2046844 1.9616431 1.151808 ] [ 0.82895 2.8073985 3.2201298 ] [ 2.0522014 0.678051 3.4629286 ] [ 2.106853 1.7229006 -0.1893673 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0048069e-10 -1.436895e-11 1.3918491e-10 ] [ -2.046844e-11 1.9616431e-10 1.151808e-10 ] [ 8.2895e-11 2.8073985e-10 3.2201298e-10 ] [ 2.0522014e-10 6.78051e-11 3.4629286e-10 ] [ 2.106853e-10 1.7229006e-10 -1.893673e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.01e-05 3.16e-05 1.35e-05 ] [ 5.5e-05 -9e-06 -1.03e-05 ] [ -1.84e-05 -2.06e-05 1.08e-05 ] [ 0.0 3.7e-06 2.6e-06 ] [ -2.65e-05 -5.7e-06 -1.66e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.61819840034e-14 5.06287816344e-14 2.162938455899999e-14 ] [ 8.811971486999999e-14 -1.4419589706e-14 -1.65024193302e-14 ] [ -2.94800500656e-14 -3.300483866039999e-14 1.73035076472e-14 ] [ 0.0 5.9280535458e-15 4.165659248399999e-15 ] [ -4.2457680801e-14 -9.1324068138e-15 -2.65961321244e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.065358 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.933083466844497e-18 } }