{ "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" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 10.5953096 -20.1572934 -47.8906884 ] [ -22.3643842 20.1626826 40.921179 ] [ -0.373329 0.1939593 -0.0272663 ] [ 0.6767584 -0.9402505 -0.1334908 ] [ 11.4656452 0.740902 7.1302665 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.69755573312578e-08 -3.229554422408614e-08 -7.672934130849776e-08 ] [ -3.583169350382891e-08 3.230417867433096e-08 6.556295628937192e-08 ] [ -5.981389956666433e-10 3.107570558467335e-10 -4.368542839571905e-11 ] [ 1.084286486410015e-09 -1.50644736879551e-09 -2.138758388518887e-10 ] [ 1.836998868182774e-08 1.187055862703962e-09 1.142394628637344e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.7712835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.246615495708798e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2265139 1.8397406 -0.2751243 ] [ 0.1486219 3.3396199 1.4972947 ] [ 1.8433625 0.2425597 0.2065286 ] [ 2.7647426 0.7553226 2.2766266 ] [ 1.7173343 2.6694106 3.07436 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.265139e-11 1.8397406e-10 -2.751243e-11 ] [ 1.486219e-11 3.3396199e-10 1.4972947e-10 ] [ 1.8433625e-10 2.425597e-11 2.065286e-11 ] [ 2.7647426e-10 7.553226e-11 2.2766266e-10 ] [ 1.7173343e-10 2.6694106e-10 3.07436e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.5e-06 -2.8e-06 -6e-07 ] [ 6.7e-06 -8e-06 -9e-07 ] [ -3.6e-06 1.4e-06 -3.7e-06 ] [ -7.6e-06 9.1e-06 -1e-06 ] [ 3e-06 4e-07 6.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.4032649312e-15 -4.48609453824e-15 -9.6130597248e-16 ] [ 1.073458335936e-14 -1.28174129664e-14 -1.44195895872e-15 ] [ -5.76783583488e-15 2.24304726912e-15 -5.928053496960001e-15 ] [ -1.217654231808e-14 1.457980724928e-14 -1.6021766208e-15 ] [ 4.8065298624e-15 6.408706483200001e-16 9.93349504896e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.435336 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992360461099259e-18 } }