{ "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" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.2482177 -3.7803329 -23.9010195 ] [ -8.5177467 3.1790221 21.066885 ] [ -1.1818839 -14.500717 0.8113204 ] [ -5.5805096 15.6466414 -3.2194453 ] [ 21.5283579 -0.5446135 5.2422593 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.001074832060875e-08 -6.056760991221064e-09 -3.829365465618491e-08 ] [ -1.364693462463635e-08 5.09335488562652e-09 3.375287062008221e-08 ] [ -1.893586753079925e-09 -2.323270976223711e-08 1.299878576858105e-09 ] [ -8.940962013269959e-09 2.506868304512138e-08 -5.158119991604442e-09 ] [ 3.449223171159499e-08 -8.725670170720608e-10 8.399025290631373e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.2628418 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.003417871172899e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7262329 2.4573382 -0.244529 ] [ 2.6970133 4.0099114 3.0916947 ] [ 3.1945046 0.9782209 0.8456629 ] [ 1.4187737 4.3310308 1.1435898 ] [ 3.7945925 1.9378284 2.9075018 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7262329e-10 2.4573382e-10 -2.44529e-11 ] [ 2.6970133e-10 4.0099114e-10 3.0916947e-10 ] [ 3.1945046e-10 9.782209e-11 8.456629e-11 ] [ 1.4187737e-10 4.3310308e-10 1.1435898e-10 ] [ 3.7945925e-10 1.9378284e-10 2.9075018e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.1e-06 -5e-07 -1.6e-06 ] [ 1.57e-05 -6.3e-06 1e-07 ] [ 7.9e-06 1.16e-05 6.7e-06 ] [ 1.9e-06 -1.1e-05 1.3e-06 ] [ -2.13e-05 6.3e-06 -6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.568924145279999e-15 -8.010883104e-16 -2.56348259328e-15 ] [ 2.515417294656e-14 -1.009371271104e-14 1.6021766208e-16 ] [ 1.265719530432e-14 1.858524880128e-14 1.073458335936e-14 ] [ 3.04413557952e-15 -1.76239428288e-14 2.08282960704e-15 ] [ -3.412636202304e-14 1.009371271104e-14 -1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }