{ "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" [ [ 0.0562169 0.1968178 1.270009 ] [ 0.319021 0.1442605 2.935142 ] [ 0.1524012 2.469722 2.823059 ] [ 2.088827 0.2993275 0.454611 ] [ 2.473305 0.2789971 2.995912 ] [ 2.138376 2.393894 2.931206 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.62169e-12 1.968178e-11 1.270009e-10 ] [ 3.19021e-11 1.442605e-11 2.935142e-10 ] [ 1.524012e-11 2.469722e-10 2.823059e-10 ] [ 2.088827e-10 2.993275e-11 4.54611e-11 ] [ 2.473305e-10 2.789971e-11 2.995912e-10 ] [ 2.138376e-10 2.393894e-10 2.931206e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.4062978 0.322341 -31.7497056 ] [ 0.3574074 -3.0519741 31.8075875 ] [ -7.0396559 1.3227573 -0.1213426 ] [ 1.9886888 -0.0938974 -0.3551617 ] [ 4.3423422 -2.0118705 -0.2250759 ] [ 7.7575154 3.5126437 0.6436983 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.186619718184248e-08 5.164472141252928e-10 -5.086863602960284e-08 ] [ 5.726297803809138e-10 -4.889801550307121e-09 5.096137305655032e-08 ] [ -1.127877210145678e-08 2.119290821052532e-09 -1.944122768270861e-10 ] [ 3.186230701406807e-09 -1.50440219033906e-10 -5.690317723435835e-10 ] [ 6.957199152353238e-09 -3.223371879177207e-09 -3.606113448855187e-10 ] [ 1.242890980937596e-08 5.627875613340409e-09 1.031318367108705e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4981478 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.521771034606296e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0886551 0.5875282 0.9682419 ] [ 0.365935 -0.0457777 3.3300142 ] [ -0.0001244 2.3111158 2.6251594 ] [ 2.0989222 0.0216784 0.5971377 ] [ 2.6214297 0.3221816 2.8267632 ] [ 2.2306397 2.5862926 3.0626225 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.86551e-12 5.875281999999999e-11 9.682419e-11 ] [ 3.65935e-11 -4.57777e-12 3.3300142e-10 ] [ -1.244e-14 2.3111158e-10 2.6251594e-10 ] [ 2.0989222e-10 2.16784e-12 5.971377e-11 ] [ 2.6214297e-10 3.221816e-11 2.8267632e-10 ] [ 2.2306397e-10 2.5862926e-10 3.0626225e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.56e-05 3.04e-05 5e-06 ] [ -5.1e-06 5e-07 -3.1e-06 ] [ -2.08e-05 -2.4e-06 8e-07 ] [ 1.69e-05 -2.34e-05 2.5e-06 ] [ 2.93e-05 9.5e-06 -6e-07 ] [ -4.7e-06 -1.47e-05 -4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.499395528448e-14 4.870616927232e-14 8.010883104e-15 ] [ -8.17110076608e-15 8.010883104e-16 -4.96674752448e-15 ] [ -3.332527371264e-14 -3.84522388992e-15 1.28174129664e-15 ] [ 2.707678489152e-14 -3.749093292672001e-14 4.005441552e-15 ] [ 4.694377498944e-14 1.52206778976e-14 -9.6130597248e-16 ] [ -7.53023011776e-15 -2.355199632576e-14 -7.370012455680001e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.373205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.943711950016567e-18 } }