{ "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" [ [ 0.5633223 0.534565 2.657113 ] [ 0.571871 1.718695 0.3060373 ] [ 0.67165 2.82724 1.843012 ] [ 2.670346 0.5025148 0.7068498 ] [ 2.297338 0.3834159 2.609917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.633223000000001e-11 5.34565e-11 2.657113e-10 ] [ 5.71871e-11 1.718695e-10 3.060373e-11 ] [ 6.7165e-11 2.82724e-10 1.843012e-10 ] [ 2.670346e-10 5.025148000000001e-11 7.068498e-11 ] [ 2.297338e-10 3.834159e-11 2.609917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.7948718 -1.4114508 6.9390178 ] [ -2.145492 -3.0662074 -12.7483356 ] [ -1.4232977 10.032658 7.2599874 ] [ 6.0270268 -0.5270117 -12.2752709 ] [ 18.3366348 -5.0279881 10.8246013 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.331705743049321e-08 -2.261393473169456e-09 1.111753209047505e-08 ] [ -3.437457122513434e-09 -4.912605810803954e-09 -2.042508525243235e-08 ] [ -2.280374299378412e-09 1.607409009208209e-08 1.163178207958258e-08 ] [ 9.656361431895037e-09 -8.443658246280633e-10 -1.966715204996658e-08 ] [ 2.937852758070768e-08 -8.055724983480612e-09 1.734292313234129e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.96154095 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.540558430031822e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6540148 1.1135907 3.4966984 ] [ 1.128955 2.0857326 -0.1516212 ] [ -0.1446289 2.5085029 1.7798268 ] [ 2.7148537 0.4297093 0.3716135 ] [ 2.4213327 -0.1711048 2.6264116 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.540148e-11 1.1135907e-10 3.4966984e-10 ] [ 1.128955e-10 2.0857326e-10 -1.516212e-11 ] [ -1.446289e-11 2.5085029e-10 1.7798268e-10 ] [ 2.7148537e-10 4.297093e-11 3.716135e-11 ] [ 2.4213327e-10 -1.711048e-11 2.6264116e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.9e-06 1.2e-05 -4.8e-06 ] [ 2.56e-05 -1.68e-05 -2.1e-06 ] [ 4.34e-05 -5.56e-05 2.12e-05 ] [ -3.13e-05 2.37e-05 8.2e-06 ] [ -3.37e-05 3.67e-05 -2.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.24848882112e-15 1.92261194496e-14 -7.69044777984e-15 ] [ 4.101572149248001e-14 -2.691656722944e-14 -3.36457090368e-15 ] [ 6.953446534272e-14 -8.908102011648e-14 3.396614436096001e-14 ] [ -5.014812823104e-14 3.797158591296e-14 1.313784829056e-14 ] [ -5.399335212096e-14 5.879988198335999e-14 -3.604897396800001e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.837104 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736295466597816e-18 } }