{ "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" [ [ 0.0530675 0.4696746 -0.5986347 ] [ 0.842981 -0.8150106 0.7476614 ] [ -0.5065367 0.369569 1.0617586 ] [ 0.0787666 0.7824359 -0.5598653 ] [ -0.4682784 -0.8066689 -0.6509199 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.5023507824304e-11 7.525016635035917e-10 -9.591185207396216e-10 ] [ 1.350604449978605e-09 -1.305790929024181e-09 1.197885615354597e-09 ] [ -8.115612583171832e-10 5.921148115724352e-10 1.701124805853339e-09 ] [ 1.261980050199053e-10 1.253600506254607e-09 -8.970030944571783e-10 ] [ -7.502647045056308e-10 -1.292426052306453e-09 -1.042888645793474e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.535316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.008379022954017e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3285968 2.2804142 2.7422691 ] [ 2.7077858 4.5366323 2.0168041 ] [ 4.3253982 2.8367848 1.5459769 ] [ 4.4460147 2.2879169 3.8723553 ] [ 4.8251875 4.5441468 3.1469157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3285968e-10 2.2804142e-10 2.7422691e-10 ] [ 2.7077858e-10 4.5366323e-10 2.0168041e-10 ] [ 4.325398200000001e-10 2.8367848e-10 1.5459769e-10 ] [ 4.4460147e-10 2.2879169e-10 3.8723553e-10 ] [ 4.8251875e-10 4.5441468e-10 3.1469157e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.48e-05 3.8e-06 -1.07e-05 ] [ 0.0 -8.1e-06 1.73e-05 ] [ -5.9e-06 2.4e-06 1.91e-05 ] [ -1.96e-05 2.21e-05 -1.26e-05 ] [ 6e-07 -2.02e-05 -1.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.973398019584e-14 6.08827115904e-15 -1.714328984256e-14 ] [ 0.0 -1.297763062848e-14 2.771765553984e-14 ] [ -9.45284206272e-15 3.84522388992e-15 3.060157345728e-14 ] [ -3.140266176767999e-14 3.540810331968e-14 -2.018742542208e-14 ] [ 9.6130597248e-16 -3.236396774016e-14 -2.114873139456e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137319633913408e-18 } }