{ "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" [ [ 0.2973138 0.0992835 1.535424 ] [ 0.4571454 2.256303 0.112609 ] [ 1.021874 2.429871 2.604005 ] [ 1.808416 0.4621254 0.960442 ] [ 2.7331 1.011411 2.670813 ] [ 2.623171 2.959224 2.230467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.973138000000001e-11 9.92835e-12 1.535424e-10 ] [ 4.571454e-11 2.256303e-10 1.12609e-11 ] [ 1.021874e-10 2.429871e-10 2.604005e-10 ] [ 1.808416e-10 4.621254e-11 9.60442e-11 ] [ 2.7331e-10 1.011411e-10 2.670813e-10 ] [ 2.623171e-10 2.959224e-10 2.230467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -39.9513632 -15.2415342 12.7768365 ] [ -2.8388877 4.150084 -6.71229 ] [ -37.2031033 12.2107352 24.2822764 ] [ 37.7286426 -9.5321228 -37.3661297 ] [ 14.554813 -11.7199376 18.1329618 ] [ 27.7098986 20.1327753 -11.1136551 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.400914008812948e-08 -2.441962976036363e-08 2.04707487280841e-08 ] [ -4.548399502016684e-09 6.649167559156147e-09 -1.075427411002963e-08 ] [ -5.960594232846733e-08 1.956375446021961e-08 3.890449554788359e-08 ] [ 6.044794910823893e-08 -1.527214429675463e-08 -5.986713941512051e-08 ] [ 2.331938110871591e-08 -1.877741001995486e-08 2.905220746181949e-08 ] [ 4.439615170165865e-08 3.22562618974797e-08 -1.780603837285469e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 28.895697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.62960101751207e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5091103 -0.2066733 1.5734059 ] [ 0.4515127 1.9114721 -0.4323893 ] [ 0.8577349 3.0291482 2.8802605 ] [ 1.0210099 -0.2170883 -0.5744099 ] [ 3.1083511 1.251268 3.4159286 ] [ 2.9933013 3.4500912 3.2509643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.091103e-11 -2.066733e-11 1.5734059e-10 ] [ 4.515127e-11 1.9114721e-10 -4.323893e-11 ] [ 8.577349e-11 3.0291482e-10 2.8802605e-10 ] [ 1.0210099e-10 -2.170883e-11 -5.744099000000001e-11 ] [ 3.1083511e-10 1.251268e-10 3.4159286e-10 ] [ 2.993301300000001e-10 3.4500912e-10 3.2509643e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9e-07 -9e-06 5.7e-06 ] [ 2.3e-06 -4e-07 -9.1e-06 ] [ -1.46e-05 8.6e-06 -3.3e-06 ] [ -3.2e-06 9.4e-06 3.4e-06 ] [ 1.01e-05 1.91e-05 6e-07 ] [ 4.5e-06 -2.77e-05 2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.44195895872e-15 -1.44195895872e-14 9.13240673856e-15 ] [ 3.68500622784e-15 -6.408706483200001e-16 -1.457980724928e-14 ] [ -2.339177866368e-14 1.377871893888e-14 -5.28718284864e-15 ] [ -5.126965186560001e-15 1.506046023552e-14 5.44740051072e-15 ] [ 1.618198387008e-14 3.060157345728e-14 9.6130597248e-16 ] [ 7.2097947936e-15 -4.438029239616e-14 4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.702322 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.67600698214735e-18 } }