{ "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" [ [ 1.201304 1.645112 1.368441 ] [ 2.96083 0.196256 2.000233 ] [ 1.817638 2.196428 3.68098 ] [ 1.740873 3.89811 0.9150282 ] [ 4.00836 2.276208 0.7214657 ] [ 3.949621 2.27126 3.236775 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.201304e-10 1.645112e-10 1.368441e-10 ] [ 2.96083e-10 1.96256e-11 2.000233e-10 ] [ 1.817638e-10 2.196428e-10 3.68098e-10 ] [ 1.740873e-10 3.89811e-10 9.150282e-11 ] [ 4.00836e-10 2.276208e-10 7.214657e-11 ] [ 3.949621e-10 2.27126e-10 3.236775e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3567668 -0.1309781 1.4448766 ] [ 0.9830866 2.2629353 -0.5040603 ] [ -3.6520401 -0.3016047 -0.0910299 ] [ 4.5484534 -3.1417023 -0.6863683 ] [ -4.4074864 2.2126464 1.9917158 ] [ 2.8847532 -0.9012965 -2.1551339 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.716034260376295e-10 -2.098500496568045e-10 2.314947508460993e-09 ] [ 1.575078366741761e-09 3.625622032043035e-09 -8.075936281334343e-10 ] [ -5.851213266444093e-09 -4.832239990633978e-10 -1.458459775737619e-10 ] [ 7.28742569827827e-09 -5.033561974573588e-09 -1.099683243518241e-09 ] [ -7.061571666573957e-09 3.545050332177286e-09 3.191080490037968e-09 ] [ 4.621884133817987e-09 -1.444036180708867e-09 -3.452905149273525e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.879598 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.544192066330244e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0580643 1.7634379 1.7991725 ] [ 3.0349626 0.5265261 1.5440816 ] [ 1.7099968 2.2702715 3.9917743 ] [ 1.9274524 3.3720206 0.3342458 ] [ 4.0421879 2.6206676 0.9812525 ] [ 3.9059619 1.9304503 3.2723963 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0580643e-10 1.7634379e-10 1.7991725e-10 ] [ 3.0349626e-10 5.265261e-11 1.5440816e-10 ] [ 1.7099968e-10 2.2702715e-10 3.9917743e-10 ] [ 1.9274524e-10 3.3720206e-10 3.342458e-11 ] [ 4.0421879e-10 2.6206676e-10 9.812525e-11 ] [ 3.9059619e-10 1.9304503e-10 3.2723963e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.78e-05 2.54e-05 1.4e-05 ] [ 6.9e-06 -2.27e-05 3.86e-05 ] [ -8.5e-06 -3.88e-05 -7.4e-06 ] [ 8.8e-06 2.5e-05 -9.1e-06 ] [ -2.06e-05 -1.54e-05 1.17e-05 ] [ -1.44e-05 2.66e-05 -4.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.454051005824e-14 4.069528616832e-14 2.24304726912e-14 ] [ 1.105501868352e-14 -3.636940929216e-14 6.184401756288e-14 ] [ -1.36185012768e-14 -6.216445288704e-14 -1.185610699392e-14 ] [ 1.409915426304e-14 4.005441552e-14 -1.457980724928e-14 ] [ -3.300483838848e-14 -2.467351996032e-14 1.874546646336e-14 ] [ -2.307134333952e-14 4.261789811328e-14 -7.658404247424001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.152501 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.908351271124862e-18 } }