{ "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" [ [ 0.3890178 0.3060136 0.2686133 ] [ 1.00003 0.111897 2.250713 ] [ 0.4846776 2.300953 2.298336 ] [ 2.957925 0.3909324 0.2522672 ] [ 2.37443 2.221414 1.416157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.890178e-11 3.060136e-11 2.686133e-11 ] [ 1.00003e-10 1.11897e-11 2.250713e-10 ] [ 4.846776e-11 2.300953e-10 2.298336e-10 ] [ 2.957925e-10 3.909324e-11 2.522672e-11 ] [ 2.37443e-10 2.221414e-10 1.416157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0039842 1.8674685 -3.7383093 ] [ 2.5857707 -2.7742242 4.2386956 ] [ -5.1183345 1.4970022 1.2824959 ] [ -1.0822779 -1.9697661 -0.4557272 ] [ 3.6188259 1.3795196 -1.3271549 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.383392092591361e-12 2.992014370780445e-09 -5.989431761779213e-09 ] [ 4.142861362289651e-09 -4.444797154097583e-09 6.791138993007828e-09 ] [ -8.200475873334058e-09 2.398461926126166e-09 2.054784947251855e-09 ] [ -1.73400034858852e-09 -3.155913193864395e-09 -7.301554653026458e-10 ] [ 5.797998251725519e-09 2.210234051055368e-09 -2.126336552960162e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.76506 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.045188069510925e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4889732 0.8751991 0.1500909 ] [ 1.4581726 0.0807437 2.4319725 ] [ 0.0704023 2.1458876 2.2553392 ] [ 2.8120308 -0.0134048 0.3390945 ] [ 2.3765016 2.2427843 1.3095895 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.889732e-11 8.751991e-11 1.500909e-11 ] [ 1.4581726e-10 8.07437e-12 2.4319725e-10 ] [ 7.04023e-12 2.1458876e-10 2.2553392e-10 ] [ 2.8120308e-10 -1.34048e-12 3.390945e-11 ] [ 2.3765016e-10 2.2427843e-10 1.3095895e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.31e-05 -9.5e-06 -6.6e-06 ] [ 8.7e-06 -1.9e-06 -1.06e-05 ] [ -8.6e-06 9e-06 1.01e-05 ] [ -1.84e-05 1.52e-05 1.26e-05 ] [ 5.2e-06 -1.27e-05 -5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.098851373248e-14 -1.52206778976e-14 -1.057436569728e-14 ] [ 1.393893660096e-14 -3.04413557952e-15 -1.698307218048e-14 ] [ -1.377871893888e-14 1.44195895872e-14 1.618198387008e-14 ] [ -2.948004982272e-14 2.435308463616e-14 2.018742542208e-14 ] [ 8.33131842816e-15 -2.034764308416e-14 -8.8119714144e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }