{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1134389 0.630545 -0.7136524 ] [ 0.8524892 -0.7697473 0.8193852 ] [ -0.4591097 0.3280961 1.1772113 ] [ 0.3407956 0.6819733 -0.4992878 ] [ -0.6207363 -0.870867 -0.7836562 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.817491534692691e-10 1.010244457362336e-09 -1.14339719065781e-09 ] [ 1.365838265724495e-09 -1.233271127983924e-09 1.312799810869532e-09 ] [ -7.355748277225018e-10 5.256679007956589e-10 1.886100422601575e-09 ] [ 5.460147427915084e-10 1.092641677269825e-09 -7.999472402106662e-10 ] [ -9.94529187541895e-10 -1.395282747226233e-09 -1.255555642384969e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.706174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.516406478501682e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3258163 2.2955421 2.7625858 ] [ 2.704726 4.5368826 2.0371876 ] [ 4.3617437 2.8057321 1.4780222 ] [ 4.4309203 2.3031769 3.8859121 ] [ 4.8097768 4.5445613 3.1606132 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3258163e-10 2.2955421e-10 2.7625858e-10 ] [ 2.704726e-10 4.5368826e-10 2.0371876e-10 ] [ 4.3617437e-10 2.8057321e-10 1.4780222e-10 ] [ 4.430920300000001e-10 2.3031769e-10 3.8859121e-10 ] [ 4.8097768e-10 4.5445613e-10 3.1606132e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.12e-05 -2.5e-06 -2.59e-05 ] [ -1.16e-05 5e-06 2.8e-05 ] [ -8.4e-06 -1.5e-05 1.92e-05 ] [ -1.96e-05 3.69e-05 -1.01e-05 ] [ 8.4e-06 -2.44e-05 -1.12e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.998791056896e-14 -4.005441552e-15 -4.149637447872e-14 ] [ -1.858524880128e-14 8.010883104e-15 4.48609453824e-14 ] [ -1.345828361472e-14 -2.4032649312e-14 3.076179111936e-14 ] [ -3.140266176767999e-14 5.912031730752001e-14 -1.618198387008e-14 ] [ 1.345828361472e-14 -3.909310954752e-14 -1.794437815296e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }