{ "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" [ [ 0.2869528 0.4871961 1.041667 ] [ 1.49337 1.111154 0.3370846 ] [ 0.208303 2.963803 0.6319363 ] [ 0.9157171 2.598087 2.560793 ] [ 2.236963 2.266905 1.430037 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.869528e-11 4.871961e-11 1.041667e-10 ] [ 1.49337e-10 1.111154e-10 3.370846e-11 ] [ 2.08303e-11 2.963803e-10 6.319363e-11 ] [ 9.157170999999999e-11 2.598087e-10 2.560793e-10 ] [ 2.236963e-10 2.266905e-10 1.430037e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -44.8953198 -27.0261027 23.1464547 ] [ 37.1665897 1.3475453 -42.9774955 ] [ -11.1052903 8.3078808 -8.201281 ] [ -17.6650481 8.6960412 28.576505 ] [ 36.4990685 8.6746354 -0.5441832 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.193023176689934e-08 -4.330058989727975e-08 3.708470857474628e-08 ] [ 5.954744109220609e-08 2.159005575128923e-09 -6.885753851063721e-08 ] [ -1.779263648585702e-08 1.33106923861532e-08 -1.313990067881124e-08 ] [ -2.830252707112746e-08 1.393259390415358e-08 4.578460821517431e-08 ] [ 5.847795423167772e-08 1.389829803184406e-08 -8.718776004721304e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 21.392634 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.427477805213119e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1992873 0.483193 1.4121872 ] [ 1.7427822 1.3398717 -0.0367264 ] [ -0.3181331 2.8366376 0.3056195 ] [ 0.8418989 2.5235353 2.5774393 ] [ 3.0740452 2.2439074 1.7429983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.992873e-11 4.83193e-11 1.4121872e-10 ] [ 1.7427822e-10 1.3398717e-10 -3.67264e-12 ] [ -3.181331e-11 2.8366376e-10 3.056195e-11 ] [ 8.418989000000001e-11 2.5235353e-10 2.5774393e-10 ] [ 3.0740452e-10 2.2439074e-10 1.7429983e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-06 3.1e-06 -3.9e-06 ] [ -6.2e-06 2.1e-06 8e-06 ] [ 4e-07 -3.2e-06 -3.6e-06 ] [ 3.1e-06 -2.4e-06 9e-07 ] [ 6e-07 3e-07 -1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.36457090368e-15 4.96674752448e-15 -6.24848882112e-15 ] [ -9.93349504896e-15 3.36457090368e-15 1.28174129664e-14 ] [ 6.408706483200001e-16 -5.126965186560001e-15 -5.76783583488e-15 ] [ 4.96674752448e-15 -3.84522388992e-15 1.44195895872e-15 ] [ 9.6130597248e-16 4.8065298624e-16 -2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.750145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.722363098921002e-18 } }