{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.61754e-11 5.979908e-11 1.8255169e-10 ] [ -1.2914298e-10 5.9510296e-10 2.7126102e-10 ] [ 2.9411182e-10 5.570184600000001e-10 -7.788781e-11 ] [ 1.6086248e-10 3.7795932e-10 6.8507915e-10 ] [ 6.993977000000001e-10 1.8531813e-10 -6.882275e-11 ] [ 6.0553746e-10 1.3536984e-10 4.708025e-10 ] ] "source-value" [ [ 0.861754 0.5979908 1.8255169 ] [ -1.2914298 5.9510296 2.7126102 ] [ 2.9411182 5.5701846 -0.7788781 ] [ 1.6086248 3.7795932 6.8507915 ] [ 6.993977 1.8531813 -0.6882275 ] [ 6.0553746 1.3536984 4.708025 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 0.0 0.0 ] [ -3.2043532416e-16 0.0 1.6021766208e-16 ] [ 0.0 1.6021766208e-16 -1.6021766208e-16 ] [ -1.6021766208e-16 0.0 1.6021766208e-16 ] [ 1.6021766208e-16 -1.6021766208e-16 -1.6021766208e-16 ] [ 1.6021766208e-16 -1.6021766208e-16 0.0 ] ] "source-value" [ [ 0.0 0.0 0.0 ] [ -2e-07 0.0 1e-07 ] [ 0.0 1e-07 -1e-07 ] [ -1e-07 0.0 1e-07 ] [ 1e-07 -1e-07 -1e-07 ] [ 1e-07 -1e-07 0.0 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.50839981326915e-32 "source-value" 9.4146912e-14 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.310402922601283e-08 -2.494601767933268e-08 -9.42886260567181e-09 ] [ -2.016095890626334e-08 2.042156494996112e-08 -2.688155967027552e-10 ] [ 3.508554671367406e-09 1.134659784543342e-08 -1.779899360225303e-08 ] [ -2.127706093535621e-09 4.759440609773392e-09 2.808100180021722e-08 ] [ 1.291770393567923e-08 -3.13352469820066e-09 -9.750395100381735e-09 ] [ 1.896643577898282e-08 -8.448061027634592e-09 9.166065104792104e-09 ] ] "source-value" [ [ -8.1788918 -15.5700797 -5.8850332 ] [ -12.5834809 12.7461384 -0.1677815 ] [ 2.1898676 7.0819894 -11.1092581 ] [ -1.3280097 2.9706092 17.5267829 ] [ 8.0625967 -1.9557923 -6.085718 ] [ 11.8379182 -5.272865 5.7210079 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 9.407087423218518e-18 "source-value" 58.714422 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.601927e-10 2.20995e-10 2.424099e-10 ] [ 1.129906e-10 4.274554e-10 2.615066e-10 ] [ 2.801527e-10 4.173724e-10 9.79437e-11 ] [ 2.35061e-10 3.246819e-10 4.113867e-10 ] [ 5.119967e-10 2.708037e-10 1.074647e-10 ] [ 4.165482e-10 2.492594e-10 3.422722e-10 ] ] "source-value" [ [ 1.601927 2.20995 2.424099 ] [ 1.129906 4.274554 2.615066 ] [ 2.801527 4.173724 0.979437 ] [ 2.35061 3.246819 4.113867 ] [ 5.119967 2.708037 1.074647 ] [ 4.165482 2.492594 3.422722 ] ] } "instance-id" 1 }