{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.6079 1.726733 2.75301 ] [ 2.002918 3.986459 1.396167 ] [ 4.133267 4.619556 1.499098 ] [ 3.466505 3.469363 3.287809 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6079e-10 1.726733e-10 2.75301e-10 ] [ 2.002918e-10 3.986459e-10 1.396167e-10 ] [ 4.133267e-10 4.619556e-10 1.499098e-10 ] [ 3.466505e-10 3.469363e-10 3.287809000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0980797 1.9359802 -0.4107428 ] [ -2.4047906 -1.2166556 -0.4515169 ] [ 1.8289452 1.1460265 -1.1007621 ] [ -0.5222343 -1.8653511 1.9630218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.759317623115078e-09 3.101782214771708e-09 -6.580825113219302e-10 ] [ -3.852899277239604e-09 -1.949297157885396e-09 -7.234098210760915e-10 ] [ 2.93029324016438e-09 1.836136865117251e-09 -1.763615301682712e-09 ] [ -8.367115860398535e-10 -2.988621922003563e-09 3.145107634080734e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.1949015 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.323149730658852e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7838115 2.3215954 2.7374685 ] [ 1.8354738 3.7723044 0.9982823 ] [ 3.8214632 4.5794942 1.7306025 ] [ 3.7698415 3.1287169 3.4697307 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7838115e-10 2.3215954e-10 2.7374685e-10 ] [ 1.8354738e-10 3.7723044e-10 9.982823e-11 ] [ 3.8214632e-10 4.5794942e-10 1.7306025e-10 ] [ 3.7698415e-10 3.1287169e-10 3.4697307e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.14e-05 -2.74e-05 -2.71e-05 ] [ 2.45e-05 1.09e-05 4.15e-05 ] [ -5.8e-06 -1.1e-05 -2.51e-05 ] [ 1.26e-05 2.75e-05 1.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.030834589312e-14 -4.389963940992e-14 -4.341898642368e-14 ] [ 3.92533272096e-14 1.746372516672e-14 6.64903297632e-14 ] [ -9.292624400640001e-15 -1.76239428288e-14 -4.021463318208e-14 ] [ 2.018742542208e-14 4.4059857072e-14 1.730350750464e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.4872904 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039378501122028e-18 } }