{ "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" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.1856201 -14.7128126 -7.4344444 ] [ -15.0920587 3.7287383 11.7871174 ] [ 1.8821442 5.3103374 -19.4073166 ] [ 15.1458126 -11.9382456 8.7649479 ] [ 7.249722 17.6119824 6.2896956 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.471698577177056e-08 -2.357252437393166e-08 -1.191129300631749e-08 ] [ -2.418014360888124e-08 5.974097329341536e-09 1.888504392490488e-08 ] [ 3.01552743421432e-09 8.508098430839858e-09 -3.109394892898375e-08 ] [ 2.426626685073806e-08 -1.912717799368847e-08 1.404299460791006e-08 ] [ 1.161533509569942e-08 2.821750644722107e-08 1.007720324226863e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 60.209756 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.646666340727253e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.477439 -1.1867327 0.0278037 ] [ 0.7393517 2.6868164 3.6982366 ] [ 4.0055602 3.1584206 -1.8604732 ] [ 5.9101584 0.2822725 2.8738149 ] [ 5.1233927 5.6874285 2.7335586 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.477439e-10 -1.1867327e-10 2.78037e-12 ] [ 7.393517e-11 2.6868164e-10 3.6982366e-10 ] [ 4.0055602e-10 3.1584206e-10 -1.8604732e-10 ] [ 5.910158400000001e-10 2.822725e-11 2.8738149e-10 ] [ 5.123392700000001e-10 5.6874285e-10 2.7335586e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0341896 -0.0942208 -0.0226259 ] [ -0.046753 0.0123115 0.0457876 ] [ 0.0156994 0.0193661 -0.079766 ] [ 0.0144012 -0.012881 0.0081093 ] [ 0.050842 0.0754242 0.0484949 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.477777779450368e-11 -1.509583629530726e-10 -3.625068800455872e-11 ] [ -7.490656355226241e-11 1.97251974669792e-11 7.335982224254208e-11 ] [ 2.515321164058752e-11 3.102791265607488e-11 -1.277992203347328e-10 ] [ 2.307326595146496e-11 -2.06376370525248e-11 1.299253087105344e-11 ] [ 8.145786375471359e-11 1.208428898825433e-10 7.769739500803392e-11 ] ] } "relaxed-potential-energy" { "source-value" 0.0146046 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.339914867613568e-21 } }