{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.43906 1.00085 1.609326 ] [ 1.205531 2.018769 3.811036 ] [ 1.566383 3.683465 1.956037 ] [ 3.913976 1.646449 1.998722 ] [ 3.334697 0.9502568 4.182978 ] [ 3.589337 3.768444 1.401362 ] [ 3.236168 3.404887 3.941176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.43906e-10 1.00085e-10 1.609326e-10 ] [ 1.205531e-10 2.018769e-10 3.811036e-10 ] [ 1.566383e-10 3.683465e-10 1.956037e-10 ] [ 3.913976e-10 1.646449e-10 1.998722e-10 ] [ 3.334697e-10 9.502568000000001e-11 4.182978000000001e-10 ] [ 3.589337e-10 3.768444e-10 1.401362e-10 ] [ 3.236168e-10 3.404887e-10 3.941176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8577888 1.0380377 0.4853873 ] [ -0.2319222 -0.1918986 -0.2613903 ] [ -3.8812288 -0.8902748 1.1591416 ] [ -0.5686314 -1.8531637 0.0700173 ] [ 0.0369658 0.2536266 0.284692 ] [ 3.7295272 1.8786293 -1.1965582 ] [ 0.0575007 -0.2349565 -0.5412897 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.374329160944087e-09 1.663119734449004e-09 7.776761840932359e-10 ] [ -3.715803266845017e-10 -3.074554504842509e-10 -4.187934275638982e-10 ] [ -6.218414043335639e-09 -1.426377470647396e-09 1.857149571716706e-09 ] [ -9.110479349327731e-10 -2.969095554655225e-09 1.121800811115398e-10 ] [ 5.922574052916864e-11 4.063546089329933e-10 4.561268665287936e-10 ] [ 5.975361286477686e-09 3.00989594360987e-09 -1.91709757346653e-09 ] [ 9.212627721963456e-11 -3.764418112049952e-10 -8.672417024198458e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.034995158928929 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.127130477107711e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5090166 1.272681 1.546525 ] [ 1.1896142 1.890257 3.8274587 ] [ 1.3939708 3.6059148 2.0249157 ] [ 3.8445955 1.4705674 1.9995077 ] [ 3.4017101 1.0727056 4.3119357 ] [ 3.7256261 3.7923966 1.4548021 ] [ 3.2206188 3.3685985 3.735492 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5090166e-10 1.272681e-10 1.546525e-10 ] [ 1.1896142e-10 1.890257e-10 3.827458700000001e-10 ] [ 1.3939708e-10 3.6059148e-10 2.0249157e-10 ] [ 3.8445955e-10 1.4705674e-10 1.9995077e-10 ] [ 3.4017101e-10 1.0727056e-10 4.3119357e-10 ] [ 3.7256261e-10 3.7923966e-10 1.4548021e-10 ] [ 3.2206188e-10 3.3685985e-10 3.735492e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.9e-05 2.31e-05 -4.44e-05 ] [ -9.9e-06 -9.8e-06 2.51e-05 ] [ -5.3e-05 2.14e-05 2.01e-05 ] [ 3.9e-05 -4.31e-05 2.74e-05 ] [ -2.26e-05 7.5e-06 -7.1e-06 ] [ -2.08e-05 -1.08e-05 -2.2e-05 ] [ 3.83e-05 1.17e-05 9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.64631220032e-14 3.701027994048e-14 -7.113664196352e-14 ] [ -1.586154854592e-14 -1.570133088384e-14 4.021463318208e-14 ] [ -8.49153609024e-14 3.428657968511999e-14 3.220375007808e-14 ] [ 6.248488821120001e-14 -6.905381235648e-14 4.389963940992e-14 ] [ -3.620919163008e-14 1.2016324656e-14 -1.137545400768e-14 ] [ -3.332527371264e-14 -1.730350750464e-14 -3.52478856576e-14 ] [ 6.136336457664001e-14 1.874546646336e-14 1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.097630158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.297383372452091e-18 } }