{ "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" [ [ 0.1779892 2.357943 0.2667025 ] [ 0.683577 1.802827 2.30843 ] [ 1.994264 0.9284256 0.4445094 ] [ 2.959137 1.015728 2.327469 ] [ 2.670153 2.85418 1.122954 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.779892e-11 2.357943e-10 2.667025e-11 ] [ 6.83577e-11 1.802827e-10 2.30843e-10 ] [ 1.994264e-10 9.284256e-11 4.445094e-11 ] [ 2.959137e-10 1.015728e-10 2.327469e-10 ] [ 2.670153e-10 2.85418e-10 1.122954e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.09526 4.1018663 -9.7273137 ] [ -4.5466385 -0.8720665 12.7776766 ] [ -6.1617354 -16.6143611 -20.2697836 ] [ 10.8182882 -8.5168363 18.4723919 ] [ 6.9853458 21.9013976 -1.2529713 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.136785978415484e-08 6.571914341652034e-09 -1.558487472172808e-08 ] [ -7.284517967944809e-09 -1.397204569594161e-09 2.047209488532856e-08 ] [ -9.872188482770643e-09 -2.661914114325854e-08 -3.24757736601564e-08 ] [ 1.733280857391792e-08 -1.364547611546301e-08 2.959603467627086e-08 ] [ 1.119175782117004e-08 3.508990748666367e-08 -2.007481339932604e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.0429081 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.670922989229335e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.1602164 2.5311919 0.2807544 ] [ 0.3827592 1.0319785 2.3993523 ] [ 1.9283847 0.9464888 0.3813972 ] [ 2.8801753 1.3941393 2.6970224 ] [ 3.4540173 3.0553052 0.7115385 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.602164e-11 2.5311919e-10 2.807544e-11 ] [ 3.827592000000001e-11 1.0319785e-10 2.3993523e-10 ] [ 1.9283847e-10 9.464888e-11 3.813972e-11 ] [ 2.8801753e-10 1.3941393e-10 2.6970224e-10 ] [ 3.4540173e-10 3.0553052e-10 7.115385e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.4e-06 -2.4e-06 1e-06 ] [ 3.5e-06 -1.4e-06 2.6e-06 ] [ -2.6e-06 1.7e-06 2.5e-06 ] [ -9.5e-06 -2.5e-06 -2.4e-06 ] [ 4.1e-06 4.6e-06 -3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.0495771896e-15 -3.845223921599999e-15 1.602176634e-15 ] [ 5.607618218999999e-15 -2.2430472876e-15 4.165659248399999e-15 ] [ -4.165659248399999e-15 2.7237002778e-15 4.005441585e-15 ] [ -1.5220678023e-14 -4.005441585e-15 -3.845223921599999e-15 ] [ 6.568924199399999e-15 7.370012516399999e-15 -5.9280535458e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.498488 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.842260879992939e-18 } }