{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.7770614e-10 1.6115459e-10 1.8570826e-10 ] [ 1.0618406e-10 3.2295028e-10 4.0218678e-10 ] [ 1.903618e-10 5.221785e-10 3.5944612e-10 ] [ 1.9964032e-10 1.4356239e-10 3.1442699e-10 ] [ 3.6902397e-10 5.4036765e-10 2.3175513e-10 ] [ 4.6181781e-10 3.6061108e-10 1.4368211e-10 ] ] "source-value" [ [ 3.7770614 1.6115459 1.8570826 ] [ 1.0618406 3.2295028 4.0218678 ] [ 1.903618 5.221785 3.5944612 ] [ 1.9964032 1.4356239 3.1442699 ] [ 3.6902397 5.4036765 2.3175513 ] [ 4.6181781 3.6061108 1.4368211 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.422146442627187e-10 -9.236708436574082e-12 -1.187683915939315e-10 ] [ -8.807757689887297e-11 -6.585234303279744e-11 3.873694568471616e-11 ] [ -2.227083181270349e-10 9.381016484809536e-11 1.971370986060807e-10 ] [ -1.561551830402995e-10 -1.132650751191456e-10 1.160350782788467e-10 ] [ 3.79617645702745e-10 -1.365889214941037e-10 -3.195188791329024e-10 ] [ -5.489121189925633e-11 2.311328832345254e-10 8.637814815719042e-11 ] ] "source-value" [ [ 0.0887634 -0.0057651 -0.0741294 ] [ -0.0549737 -0.0411018 0.0241777 ] [ -0.1390036 0.0585517 0.1230433 ] [ -0.0974644 -0.0706945 0.0724234 ] [ 0.2369387 -0.0852521 -0.199428 ] [ -0.0342604 0.1442618 0.053913 ] ] } "species" { "source-value" [ "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" -2.391981762565678e-18 "source-value" -14.929576 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 9.22740828194332e-09 -2.643407654661594e-09 -2.745557693561005e-08 ] [ -1.910665282943472e-08 -2.477793220852091e-09 1.905868077749006e-08 ] [ -2.594481346321577e-09 1.182733734921094e-08 1.171085366147827e-10 ] [ 6.906184086352683e-09 -8.259082693034611e-09 9.92323038400352e-09 ] [ 8.930779219538803e-10 1.450673998448841e-09 8.559692683688832e-11 ] [ 4.674463885506414e-09 1.022722208885126e-10 -1.729039529117537e-09 ] ] "source-value" [ [ 5.7592953 -1.6498853 -17.1364234 ] [ -11.9254348 -1.5465169 11.895493 ] [ -1.6193479 7.3820434 0.0730934 ] [ 4.3105011 -5.154914 6.1935933 ] [ 0.5574154 0.9054395 0.0534254 ] [ 2.9175709 0.0638333 -1.0791816 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.158295398466942e-18 "source-value" -7.2295113 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.510917e-10 2.898515000000001e-10 1.87318e-10 ] [ 1.068289e-10 2.930408e-10 3.679489e-10 ] [ 1.738918e-10 4.773151000000001e-10 2.611531e-10 ] [ 3.136153000000001e-10 2.016935e-10 3.604220000000001e-10 ] [ 3.930075e-10 4.659698e-10 3.066974e-10 ] [ 4.662989e-10 3.229538e-10 1.53666e-10 ] ] "source-value" [ [ 2.510917 2.898515 1.87318 ] [ 1.068289 2.930408 3.679489 ] [ 1.738918 4.773151 2.611531 ] [ 3.136153 2.016935 3.60422 ] [ 3.930075 4.659698 3.066974 ] [ 4.662989 3.229538 1.53666 ] ] } "instance-id" 1 }