{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.248369 0.1750326 1.959235 ] [ 0.2041437 1.690187 0.8451771 ] [ 0.5672117 2.337944 2.235934 ] [ 2.305261 0.0188332 0.1900716 ] [ 2.629759 0.4646214 2.471997 ] [ 1.518408 2.931316 1.102854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.248369e-10 1.750326e-11 1.959235e-10 ] [ 2.041437e-11 1.690187e-10 8.451771e-11 ] [ 5.672117e-11 2.337944e-10 2.235934e-10 ] [ 2.305261e-10 1.88332e-12 1.900716e-11 ] [ 2.629759e-10 4.646214e-11 2.471997e-10 ] [ 1.518408e-10 2.931316e-10 1.102854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -65.1999215 -25.9916497 -18.8190678 ] [ -44.787553 -42.2714581 -61.1396263 ] [ -23.2833052 14.7490057 94.6892068 ] [ 5.068569 -7.6385534 -17.32567 ] [ 73.272713 9.9641958 38.9458291 ] [ 54.9294978 51.1884597 -36.3506718 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.044617899052953e-07 -4.164321348536334e-08 -3.015147045441009e-08 ] [ -7.175757031944091e-08 -6.772634189494678e-08 -9.795647986230881e-08 ] [ -3.730396724639107e-08 2.363051211258594e-08 1.517088333770564e-07 ] [ 8.120742752711636e-09 -1.223831167421235e-08 -2.775878341369593e-08 ] [ 1.173958277111882e-07 1.596440155583355e-08 6.23980968616923e-08 ] [ 8.800675716744504e-08 8.2012953386103e-08 -5.824019650833385e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 68.235168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.093247908859603e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.7052865 -0.3007112 2.034187 ] [ -0.0502872 1.5261186 0.4272194 ] [ 0.5624879 2.101456 2.8126615 ] [ 2.1880758 0.3931618 0.1063071 ] [ 3.1135062 0.5473016 2.9454812 ] [ 1.9540832 3.3506074 0.4794124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.052865000000001e-11 -3.007112e-11 2.034187e-10 ] [ -5.02872e-12 1.5261186e-10 4.272194e-11 ] [ 5.624879000000001e-11 2.101456e-10 2.8126615e-10 ] [ 2.1880758e-10 3.931618e-11 1.063071e-11 ] [ 3.1135062e-10 5.473016000000001e-11 2.9454812e-10 ] [ 1.9540832e-10 3.3506074e-10 4.794124e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.8e-06 -0.0001139 5.18e-05 ] [ -2.84e-05 4.06e-05 -4.99e-05 ] [ 5.7e-06 7.23e-05 2.97e-05 ] [ 4.54e-05 -3.15e-05 -7.3e-06 ] [ -2.33e-05 -1.09e-05 -3.15e-05 ] [ -9.2e-06 4.33e-05 7.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.570133088384e-14 -1.8248791710912e-13 8.299274895744e-14 ] [ -4.550181603071999e-14 6.504837080448e-14 -7.994861337792e-14 ] [ 9.13240673856e-15 1.1583736968384e-13 4.758464563776e-14 ] [ 7.273881858432e-14 -5.04685635552e-14 -1.169588933184e-14 ] [ -3.733071526464e-14 -1.746372516672e-14 -5.04685635552e-14 ] [ -1.474002491136e-14 6.937424768064e-14 1.137545400768e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.652045 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.507734056670954e-18 } }