{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2973138 0.0992835 1.535424 ] [ 0.4571454 2.256303 0.112609 ] [ 1.021874 2.429871 2.604005 ] [ 1.808416 0.4621254 0.960442 ] [ 2.7331 1.011411 2.670813 ] [ 2.623171 2.959224 2.230467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.973138000000001e-11 9.92835e-12 1.535424e-10 ] [ 4.571454e-11 2.256303e-10 1.12609e-11 ] [ 1.021874e-10 2.429871e-10 2.604005e-10 ] [ 1.808416e-10 4.621254e-11 9.60442e-11 ] [ 2.7331e-10 1.011411e-10 2.670813e-10 ] [ 2.623171e-10 2.959224e-10 2.230467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -37.7185663 -4.4802398 15.3953984 ] [ 1.3428609 -2.8720869 4.2342091 ] [ -30.3073122 -13.0060883 3.3143451 ] [ 36.454907 9.5935694 -19.7400354 ] [ 1.5465368 -6.5795147 5.7885903 ] [ 28.6815738 17.3443604 -8.9925075 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.043180559383982e-08 -7.178135522276832e-09 2.466614758760098e-08 ] [ 2.15150035669221e-09 -4.601590521997495e-09 6.783950883490169e-09 ] [ -4.855766744618313e-08 -2.083805077400078e-08 5.310166276232393e-09 ] [ 5.840720019004303e-08 1.53705927293374e-08 -3.162702347221284e-08 ] [ 2.477825124581131e-09 -1.054154471539952e-08 9.27434412245905e-09 ] [ 4.595294736870659e-08 2.778872896455489e-08 -1.440758539756975e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.3859093 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.629178033303295e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3685016 0.2960585 1.7387459 ] [ 0.6161012 2.2745399 0.4647913 ] [ 0.6085813 2.3825772 2.8284597 ] [ 2.3717604 0.6901646 0.5427943 ] [ 2.3642373 0.798198 2.9064637 ] [ 2.6118385 2.7766796 1.6325051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.685016e-11 2.960585e-11 1.7387459e-10 ] [ 6.161012e-11 2.2745399e-10 4.647913000000001e-11 ] [ 6.085813e-11 2.3825772e-10 2.8284597e-10 ] [ 2.3717604e-10 6.901646000000001e-11 5.427943e-11 ] [ 2.3642373e-10 7.98198e-11 2.9064637e-10 ] [ 2.6118385e-10 2.7766796e-10 1.6325051e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.63e-05 2.1e-05 2.29e-05 ] [ 2.3e-05 1.5e-06 -5.6e-06 ] [ 1.63e-05 -3.61e-05 -9e-06 ] [ -2.18e-05 -6.7e-06 -2.2e-06 ] [ -2.87e-05 1.85e-05 -1.72e-05 ] [ -1.5e-05 1.8e-06 1.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.21372454742e-14 3.364570931399999e-14 3.66898449186e-14 ] [ 3.6850062582e-14 2.403264951e-15 -8.972189150399999e-15 ] [ 2.61154791342e-14 -5.783857648740001e-14 -1.4419589706e-14 ] [ -3.492745062119999e-14 -1.07345834478e-14 -3.5247885948e-15 ] [ -4.598246939579999e-14 2.9640267729e-14 -2.75574381048e-14 ] [ -2.403264951e-14 2.8839179412e-15 1.77841606374e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.519951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.248964582702493e-18 } }