{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -2.2809345e-10 1.3736557e-10 -3.5089761e-10 ] [ -1.7929145e-10 1.436839e-11 6.7718909e-10 ] [ -2.151244e-11 9.776224900000001e-10 1.503924e-10 ] [ 4.368782600000001e-10 -5.5617779e-10 -7.375262e-11 ] [ 8.267533800000001e-10 4.2997374e-10 -8.733904000000001e-11 ] [ 8.523288900000001e-10 -2.0257026e-10 7.643175e-10 ] [ 5.5154531e-10 7.359995e-10 9.334774800000001e-10 ] ] "source-value" [ [ -2.2809345 1.3736557 -3.5089761 ] [ -1.7929145 0.1436839 6.7718909 ] [ -0.2151244 9.7762249 1.503924 ] [ 4.3687826 -5.5617779 -0.7375262 ] [ 8.2675338 4.2997374 -0.8733904 ] [ 8.5232889 -2.0257026 7.643175 ] [ 5.5154531 7.359995 9.3347748 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.8065298624e-16 -1.6021766208e-16 -4.8065298624e-16 ] [ 0.0 0.0 0.0 ] [ -1.6021766208e-16 6.408706483200001e-16 -1.6021766208e-16 ] [ 1.6021766208e-16 -6.408706483200001e-16 -3.2043532416e-16 ] [ 0.0 0.0 0.0 ] [ 4.8065298624e-16 -3.2043532416e-16 3.2043532416e-16 ] [ 1.6021766208e-16 4.8065298624e-16 4.8065298624e-16 ] ] "source-value" [ [ -3e-07 -1e-07 -3e-07 ] [ 0.0 0.0 0.0 ] [ -1e-07 4e-07 -1e-07 ] [ 1e-07 -4e-07 -2e-07 ] [ 0.0 0.0 0.0 ] [ 3e-07 -2e-07 2e-07 ] [ 1e-07 3e-07 3e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 6.27551241374771e-31 "source-value" 3.9168668e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.048026741960594e-08 -2.877053391708183e-09 -2.529936363389586e-08 ] [ -2.376783419010172e-08 -9.838983290969657e-09 2.002040748155068e-08 ] [ -1.393481676399728e-08 2.905502312701288e-08 -6.651744019380056e-09 ] [ 4.483383815615269e-09 -2.823446901154081e-08 -1.332309467515715e-08 ] [ 2.428749232639276e-08 9.951895727014564e-09 -1.882866445114257e-08 ] [ 2.023713759805252e-08 -1.619475049404752e-08 1.867248507523529e-08 ] [ 9.174904633644382e-09 1.813833749445639e-08 2.540997422278966e-08 ] ] "source-value" [ [ -12.7827776 -1.7957155 -15.7906209 ] [ -14.8347154 -6.1410104 12.4957556 ] [ -8.6974286 18.1347192 -4.1516921 ] [ 2.7983081 -17.6225696 -8.3156217 ] [ 15.1590605 6.2114848 -11.7519281 ] [ 12.6310279 -10.1079683 11.6544486 ] [ 5.7265251 11.3210599 15.8596586 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.438083113087902e-17 "source-value" 152.17318 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] "source-value" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] } "instance-id" 1 }