{ "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" [ [ 1.047673 1.456203 2.59416 ] [ 0.648425 2.408552 0.8864435 ] [ 2.028254 0.9559849 0.3097335 ] [ 1.556479 0.0798405 1.221415 ] [ 2.621496 2.506538 1.825694 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.047673e-10 1.456203e-10 2.59416e-10 ] [ 6.48425e-11 2.408552e-10 8.864435000000001e-11 ] [ 2.028254e-10 9.559849e-11 3.097335e-11 ] [ 1.556479e-10 7.98405e-12 1.221415e-10 ] [ 2.621496e-10 2.506538e-10 1.825694e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.6884134 -68.0750341 56.1396228 ] [ -66.1534063 21.6166742 -91.1469914 ] [ 1055.8474076 1998.9351838 -2045.0377637 ] [ -1068.3727943 -1970.6215432 2074.0219127 ] [ 93.3672065 18.1447193 6.0232196 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.353343254612544e-08 -1.090682280951828e-07 8.994559115069063e-08 ] [ -1.059894409601434e-07 3.463373002269054e-08 -1.460335786773387e-07 ] [ 1.691654031589008e-06 3.202647217978911e-06 -3.276511693653255e-06 ] [ -1.711721913326228e-06 -3.157283764959857e-06 3.322949419554839e-06 ] [ 1.495907554037058e-07 2.907104505343854e-08 9.650261625064328e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 637.88378 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.022002479103531e-16 } "relaxed-configuration-positions" { "source-value" [ [ 0.8908183 1.3875546 2.8759484 ] [ 0.3992334 2.8172135 0.7144026 ] [ 2.247625 1.1265306 -0.1119779 ] [ 1.4715253 -0.6897235 1.5076898 ] [ 2.8931249 2.7655433 1.8513831 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.908183e-11 1.3875546e-10 2.8759484e-10 ] [ 3.992334000000001e-11 2.8172135e-10 7.144026000000001e-11 ] [ 2.247625e-10 1.1265306e-10 -1.119779e-11 ] [ 1.4715253e-10 -6.897235000000001e-11 1.5076898e-10 ] [ 2.8931249e-10 2.7655433e-10 1.8513831e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.44e-05 1.72e-05 2.47e-05 ] [ 7.25e-05 -8.4e-06 2.83e-05 ] [ -1.17e-05 2.34e-05 -5.3e-05 ] [ -3e-07 -7.99e-05 1.32e-05 ] [ -1.61e-05 4.77e-05 -1.33e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.113664196352e-14 2.755743787776e-14 3.957376253376001e-14 ] [ 1.16157805008e-13 -1.345828361472e-14 4.534159836864e-14 ] [ -1.874546646336e-14 3.749093292672001e-14 -8.49153609024e-14 ] [ -4.8065298624e-16 -1.2801391200192e-13 2.114873139456e-14 ] [ -2.579504359488e-14 7.642382481215999e-14 -2.130894905664e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.556674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.652671600100722e-18 } }