{ "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" [ [ 1.178267 0.166744 1.149708 ] [ 0.7840536 2.31607 1.236295 ] [ 0.8079908 1.595267 2.952936 ] [ 2.817536 1.157767 1.902801 ] [ 1.934708 2.772369 0.0108268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.178267e-10 1.66744e-11 1.149708e-10 ] [ 7.840536e-11 2.31607e-10 1.236295e-10 ] [ 8.079908000000001e-11 1.595267e-10 2.952936e-10 ] [ 2.817536e-10 1.157767e-10 1.902801e-10 ] [ 1.934708e-10 2.772369e-10 1.08268e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6041437 -40.8835801 -11.6370961 ] [ -36.3485118 25.4746545 -8.3287457 ] [ -12.1457024 3.1871214 37.0593456 ] [ 40.0669072 -10.6622408 10.3051179 ] [ 17.0314507 22.884045 -27.3986217 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.378535787814361e-08 -6.550271621082413e-08 -1.864468330542286e-08 ] [ -5.823673580683293e-08 4.081489586285751e-08 -1.334412164112853e-08 ] [ -1.945956042847445e-08 5.106331394731366e-09 5.937561710246734e-08 ] [ 6.41942619836032e-08 -1.708279293509989e-08 1.651061897396759e-08 ] [ 2.72873921298478e-08 3.666428188833514e-08 -4.389743112988355e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 30.762583 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.928709127801952e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9685257 -1.1113597 0.894295 ] [ 0.2253338 3.5459771 1.4626657 ] [ 0.757238 1.8549772 3.1362647 ] [ 2.5513923 1.0135026 1.7162635 ] [ 2.0200656 2.7051197 0.043078 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9685257e-10 -1.1113597e-10 8.94295e-11 ] [ 2.253338e-11 3.5459771e-10 1.4626657e-10 ] [ 7.57238e-11 1.8549772e-10 3.1362647e-10 ] [ 2.5513923e-10 1.0135026e-10 1.7162635e-10 ] [ 2.0200656e-10 2.7051197e-10 4.3078e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.07e-05 -4.83e-05 -5.2e-06 ] [ -9.7e-06 5.46e-05 1.2e-05 ] [ -1.29e-05 -1.52e-05 1.79e-05 ] [ 1.13e-05 -3.59e-05 5.05e-05 ] [ -9.4e-06 4.49e-05 -7.53e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.316505605055999e-14 -7.738513078464e-14 -8.33131842816e-15 ] [ -1.554111322176e-14 8.747884349568e-14 1.92261194496e-14 ] [ -2.066807840832e-14 -2.435308463616e-14 2.867896151232001e-14 ] [ 1.810459581504e-14 -5.751814068672e-14 8.090991935040001e-14 ] [ -1.506046023552e-14 7.193773027392e-14 -1.2064389954624e-13 ] ] } "relaxed-potential-energy" { "source-value" -10.419499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.669387769824898e-18 } }