{ "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" [ [ 1.256228 0.2353278 1.625271 ] [ 0.7175946 2.735818 1.079118 ] [ 2.902295 0.4260222 2.532348 ] [ 1.615511 1.481432 2.901286 ] [ 2.936652 2.941975 2.695922 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.256228e-10 2.353278e-11 1.625271e-10 ] [ 7.175946e-11 2.735818e-10 1.079118e-10 ] [ 2.902295e-10 4.260222e-11 2.532348e-10 ] [ 1.615511e-10 1.481432e-10 2.901286e-10 ] [ 2.936652e-10 2.941975e-10 2.695922e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7303606 -4.7244549 -7.6450549 ] [ 0.4260652 -0.2308985 0.1052486 ] [ 12.0489749 -5.1625199 0.2568141 ] [ -9.0141176 7.8384903 8.3112094 ] [ 2.2694381 2.279383 -1.0282172 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.18104985771422e-09 -7.569411249166805e-09 -1.224872832642721e-08 ] [ 6.826317080005367e-10 -3.69940181525649e-10 1.686268476812124e-10 ] [ 1.930458604843248e-08 -8.271268756340017e-09 4.114615503017393e-10 ] [ -1.444220859484816e-08 1.255864600449565e-08 1.331602550096116e-08 ] [ 3.636040696129355e-09 3.651974182536822e-09 -1.647385572516905e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.876161932689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.812472712155674e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4988706 0.3605849 0.9094996 ] [ 0.834896 2.5616067 1.5352005 ] [ 2.936412 0.5666231 2.7983836 ] [ 0.9753441 1.5758509 3.6997814 ] [ 3.1827579 2.7559094 1.8910799 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4988706e-10 3.605849e-11 9.094996e-11 ] [ 8.34896e-11 2.5616067e-10 1.5352005e-10 ] [ 2.936412e-10 5.666231e-11 2.7983836e-10 ] [ 9.753441000000001e-11 1.5758509e-10 3.6997814e-10 ] [ 3.1827579e-10 2.7559094e-10 1.8910799e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.7e-05 -7.4e-06 2.87e-05 ] [ 6.68e-05 -6.1e-05 2.93e-05 ] [ -5.12e-05 5.69e-05 -4.75e-05 ] [ 1.65e-05 -1.2e-06 -4.14e-05 ] [ -5.1e-06 1.27e-05 3.1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.325876911799999e-14 -1.18561070916e-14 4.598246939579999e-14 ] [ 1.070253991512e-13 -9.773277467399998e-14 4.69437753762e-14 ] [ -8.20314436608e-14 9.116385047459999e-14 -7.6103390115e-14 ] [ 2.6435914461e-14 -1.9226119608e-15 -6.633011264759999e-14 ] [ -8.1711008334e-15 2.03476432518e-14 4.966747565399999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }