{ "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" [ [ 1.875325 2.956791 1.293332 ] [ 2.112421 5.47429 1.464888 ] [ 2.056962 4.106673 3.914817 ] [ 3.228113 2.011758 3.122182 ] [ 3.602336 4.040974 2.324239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.875325e-10 2.956791e-10 1.293332e-10 ] [ 2.112421e-10 5.47429e-10 1.464888e-10 ] [ 2.056962e-10 4.106673e-10 3.914817000000001e-10 ] [ 3.228113e-10 2.011758e-10 3.122182e-10 ] [ 3.602336e-10 4.040974e-10 2.324239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.3363358 -4.9084971 -6.8336188 ] [ -2.4275265 5.9629677 -2.2211009 ] [ -4.7502304 4.6833995 7.62231 ] [ 3.104576 -8.9227591 2.1982634 ] [ 9.4095167 3.184889 -0.7658537 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.549752529937696e-09 -7.86427936167676e-09 -1.094866436702312e-08 ] [ -3.8893262367158e-09 9.55372751823672e-09 -3.558595963736371e-09 ] [ -7.610708152996473e-09 7.503633246587283e-09 1.221228697910454e-08 ] [ 4.974079125677183e-09 -1.429583614083087e-08 3.522006254857395e-09 ] [ 1.507570779397279e-08 5.102754737683626e-09 -1.227032903202446e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.9003857 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.851283466127734e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7011263 2.5989033 0.5787893 ] [ 2.1831839 5.0509989 1.1229383 ] [ 2.1628215 4.7013461 4.9058816 ] [ 3.2106633 1.9272534 2.5310758 ] [ 3.617362 4.3119842 2.9807729 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7011263e-10 2.5989033e-10 5.787892999999999e-11 ] [ 2.1831839e-10 5.0509989e-10 1.1229383e-10 ] [ 2.1628215e-10 4.701346100000001e-10 4.9058816e-10 ] [ 3.2106633e-10 1.9272534e-10 2.5310758e-10 ] [ 3.617362e-10 4.311984200000001e-10 2.9807729e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-06 9.1e-06 -5.4e-06 ] [ -1.7e-05 9.3e-06 -4.1e-06 ] [ -3.5e-06 2.5e-06 -1.18e-05 ] [ 8.6e-06 -1.19e-05 1.29e-05 ] [ 1.49e-05 -8.9e-06 8.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.806529901999999e-15 1.45798073694e-14 -8.6517538236e-15 ] [ -2.723700277799999e-14 1.49002426962e-14 -6.568924199399999e-15 ] [ -5.607618218999999e-15 4.005441585e-15 -1.89056842812e-14 ] [ 1.37787190524e-14 -1.90659019446e-14 2.06680785786e-14 ] [ 2.38724318466e-14 -1.42593720426e-14 1.34582837256e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.649402 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.866439968447287e-18 } }