{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.139945 -1.4721353 -2.803537 ] [ -5.2451543 -0.3539089 4.0453627 ] [ -4.3868358 -1.3357888 -0.9977768 ] [ -0.2894493 6.0604806 2.7854709 ] [ 1.8824309 -3.671596 -5.5016166 ] [ 6.9998433 -2.8448697 3.8352869 ] [ 5.1791101 3.6178181 -1.36319 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.632923090397856e-09 -2.358620760314394e-09 -4.49176143694777e-09 ] [ -8.40366359194859e-09 -5.670245654730452e-10 6.481385540596364e-09 ] [ -7.028485758048464e-09 -2.140169585686487e-09 -1.598614661736637e-09 ] [ -4.637489013669255e-10 9.709960328131956e-09 4.462816353898735e-09 ] [ 3.015986778251502e-09 -5.882545272222797e-09 -8.814561493125185e-09 ] [ 1.121498528452352e-08 -4.55798372256231e-09 6.144807005240507e-09 ] [ 8.29784911876915e-09 5.796383578127077e-09 -2.184071147708352e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.623104 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.464403169792697e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0817022 0.9879516 2.9001304 ] [ 1.6969151 2.6262555 4.6593995 ] [ 2.171943 3.4758297 2.2875855 ] [ 3.3123488 4.4257915 4.3780243 ] [ 3.9349578 1.77495 1.5314772 ] [ 4.1166447 2.0100119 4.0779737 ] [ 4.6955415 3.8996517 2.4448665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0817022e-10 9.879516000000001e-11 2.9001304e-10 ] [ 1.6969151e-10 2.6262555e-10 4.6593995e-10 ] [ 2.171943e-10 3.4758297e-10 2.2875855e-10 ] [ 3.3123488e-10 4.4257915e-10 4.3780243e-10 ] [ 3.9349578e-10 1.77495e-10 1.5314772e-10 ] [ 4.1166447e-10 2.0100119e-10 4.0779737e-10 ] [ 4.6955415e-10 3.8996517e-10 2.4448665e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.8e-06 -3.09e-05 3.4e-06 ] [ -3.6e-06 1.1e-05 -2.48e-05 ] [ -2.1e-05 3.8e-06 -1.33e-05 ] [ 3.31e-05 1.21e-05 1.62e-05 ] [ -9.7e-06 -8.6e-06 -2.1e-06 ] [ 5e-07 -1.47e-05 1.24e-05 ] [ -4.1e-06 2.73e-05 8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.69044777984e-15 -4.950725758272e-14 5.44740051072e-15 ] [ -5.76783583488e-15 1.76239428288e-14 -3.973398019584e-14 ] [ -3.36457090368e-14 6.08827115904e-15 -2.130894905664e-14 ] [ 5.303204614848e-14 1.938633711168e-14 2.595526125696e-14 ] [ -1.554111322176e-14 -1.377871893888e-14 -3.36457090368e-15 ] [ 8.010883104e-16 -2.355199632576e-14 1.986699009792e-14 ] [ -6.568924145279999e-15 4.373942174784e-14 1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937462138501e-18 } }