{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.248369 0.1750326 1.959235 ] [ 0.2041437 1.690187 0.8451771 ] [ 0.5672117 2.337944 2.235934 ] [ 2.305261 0.0188332 0.1900716 ] [ 2.629759 0.4646214 2.471997 ] [ 1.518408 2.931316 1.102854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.248369e-10 1.750326e-11 1.959235e-10 ] [ 2.041437e-11 1.690187e-10 8.451771e-11 ] [ 5.672117e-11 2.337944e-10 2.235934e-10 ] [ 2.305261e-10 1.88332e-12 1.900716e-11 ] [ 2.629759e-10 4.646214e-11 2.471997e-10 ] [ 1.518408e-10 2.931316e-10 1.102854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -56.4725468 -17.3812721 -11.6610789 ] [ -27.7636107 -30.2485082 -47.1230869 ] [ -15.7330091 4.6145581 73.1574752 ] [ 2.9786827 -0.3459362 -8.7320676 ] [ 55.2341821 13.2633774 22.7171326 ] [ 41.7563018 30.0977808 -28.3583743 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.047899494543147e-08 -2.784786802781611e-08 -1.868310814081042e-08 ] [ -4.448220833901238e-08 -4.846345305139739e-08 -7.549950875313149e-08 ] [ -2.520705956252937e-08 7.393337164055434e-09 1.172111973678745e-07 ] [ 4.772375822040031e-09 -5.542508964947507e-10 -1.399031467522846e-08 ] [ 8.849491595872104e-08 2.125027335820367e-08 3.639685904319966e-08 ] [ 6.690097106621214e-08 4.822196113301382e-08 -4.54351246816861e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 32.321618 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.178494113267381e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6986576 -0.24407 2.0581929 ] [ 0.001028 1.5271568 0.4227156 ] [ 0.6066845 2.1594237 2.7747676 ] [ 2.2177017 0.379889 0.1603232 ] [ 2.8233565 1.0121533 2.5123709 ] [ 2.1257241 2.7833815 0.8768985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.986576e-11 -2.4407e-11 2.0581929e-10 ] [ 1.028e-13 1.5271568e-10 4.227156e-11 ] [ 6.066844999999999e-11 2.1594237e-10 2.7747676e-10 ] [ 2.2177017e-10 3.79889e-11 1.603232e-11 ] [ 2.8233565e-10 1.0121533e-10 2.5123709e-10 ] [ 2.1257241e-10 2.7833815e-10 8.768985e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.05e-05 7.15e-05 -3.37e-05 ] [ -1.81e-05 7.1e-06 1e-07 ] [ 3.09e-05 -5.15e-05 -7.35e-05 ] [ -4.94e-05 3.37e-05 5.94e-05 ] [ 2.32e-05 -8e-06 3.31e-05 ] [ -2.7e-05 -5.29e-05 1.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.4888153677e-14 1.14555629331e-13 -5.399335256579999e-14 ] [ -2.899939707539999e-14 1.13754541014e-14 1.602176634e-16 ] [ 4.950725799059999e-14 -8.251209665099998e-14 -1.17759982599e-13 ] [ -7.91475257196e-14 5.399335256579999e-14 9.51692920596e-14 ] [ 3.71704979088e-14 -1.2817413072e-14 5.303204658539999e-14 ] [ -4.325876911799999e-14 -8.475514393859999e-14 2.33917788564e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.422831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.951662936033085e-18 } }