{ "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" [ [ 0.7826629 0.079664 0.3147899 ] [ 0.4004832 1.295186 0.8087518 ] [ 0.7320587 0.6290848 2.788823 ] [ 1.344916 2.662801 0.2560168 ] [ 0.3963272 2.667865 2.000738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.826629000000001e-11 7.9664e-12 3.147899e-11 ] [ 4.004832e-11 1.295186e-10 8.087518e-11 ] [ 7.320586999999999e-11 6.290848000000001e-11 2.788823e-10 ] [ 1.344916e-10 2.662801e-10 2.560168e-11 ] [ 3.963272e-11 2.667865e-10 2.000738e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.4072794 -6.4962478 -3.6188199 ] [ -18.5184412 -35.6518842 -14.3625005 ] [ 1.4631547 -8.1995975 8.3420927 ] [ 24.6412158 19.9286374 -28.3080136 ] [ -10.9932087 30.4190921 37.9472413 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.459063395213452e-09 -1.040813634808343e-08 -5.797988638665794e-09 ] [ -2.96698135442995e-08 -5.712061535270891e-08 -2.301126251732831e-08 ] [ 2.344232252953638e-09 -1.313720341447013e-08 1.336550589248635e-08 ] [ 3.947957986284757e-08 3.19291969266805e-08 -4.535443757120844e-08 ] [ -1.761306196671516e-08 4.873675818858198e-08 6.07981828347162e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 19.63803040076505 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.146359318666542e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0715367 -0.61879 0.6223136 ] [ -0.0629649 1.416073 0.5183857 ] [ 0.6318316 0.4523947 2.5987592 ] [ 1.2671095 3.2913101 0.1272981 ] [ 0.7489351 2.7936129 2.3023629 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0715367e-10 -6.1879e-11 6.223136000000001e-11 ] [ -6.296490000000001e-12 1.416073e-10 5.183856999999999e-11 ] [ 6.318316000000001e-11 4.523947e-11 2.5987592e-10 ] [ 1.2671095e-10 3.2913101e-10 1.272981e-11 ] [ 7.489351e-11 2.7936129e-10 2.3023629e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 1.4e-06 -1e-07 ] [ -1e-07 -7e-07 9e-07 ] [ 1e-07 -1.4e-06 -7e-07 ] [ 4e-07 -1.2e-06 6e-07 ] [ -2e-07 1.9e-06 -7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 2.24304726912e-15 -1.6021766208e-16 ] [ -1.6021766208e-16 -1.12152363456e-15 1.44195895872e-15 ] [ 1.6021766208e-16 -2.24304726912e-15 -1.12152363456e-15 ] [ 6.408706483200001e-16 -1.92261194496e-15 9.6130597248e-16 ] [ -3.2043532416e-16 3.04413557952e-15 -1.12152363456e-15 ] ] } "relaxed-potential-energy" { "source-value" -4.883549399234948 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.824308673976119e-19 } }