{ "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" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.9475175 -16.4499456 -10.2660654 ] [ -23.9986025 8.3073721 -2.3524553 ] [ -14.5131953 12.6567036 6.7039095 ] [ 24.4924282 -7.5083517 2.7946559 ] [ 7.0718521 2.9942215 3.1199553 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.113115020280609e-08 -2.635571847089111e-08 -1.644805010699586e-08 ] [ -3.845000017415399e-08 1.330987746856351e-08 -3.76904891418946e-09 ] [ -2.325270239433862e-08 2.027827477138368e-08 1.074084715735062e-08 ] [ 3.924119617196267e-08 -1.202970565359418e-08 4.477532383050241e-09 ] [ 1.133035619372383e-08 4.797271724320431e-09 4.998719480784459e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.229857 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.174801416561338e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0774291 0.1036139 1.4203394 ] [ 0.3291526 2.0503995 0.1032465 ] [ -0.0574486 2.0089426 2.5003387 ] [ 2.7028907 1.7031054 0.4800591 ] [ 2.3162921 1.6616706 2.8771536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0774291e-10 1.036139e-11 1.4203394e-10 ] [ 3.291526e-11 2.0503995e-10 1.032465e-11 ] [ -5.74486e-12 2.0089426e-10 2.5003387e-10 ] [ 2.7028907e-10 1.7031054e-10 4.800591e-11 ] [ 2.3162921e-10 1.6616706e-10 2.8771536e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.2e-06 1.16e-05 2.6e-06 ] [ 1.9e-06 -6.2e-06 -8e-07 ] [ 2.6e-06 2.9e-06 3e-07 ] [ -7.2e-06 1.3e-06 1.11e-05 ] [ -3.6e-06 -9.5e-06 -1.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.9334951308e-15 1.85852489544e-14 4.165659248399999e-15 ] [ 3.0441356046e-15 -9.9334951308e-15 -1.2817413072e-15 ] [ 4.165659248399999e-15 4.6463122386e-15 4.806529901999999e-16 ] [ -1.15356717648e-14 2.0828296242e-15 1.77841606374e-14 ] [ -5.767835882399999e-15 -1.5220678023e-14 -2.11487315688e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.391586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.305786281540152e-18 } }