{ "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" [ [ 1.816977 2.980856 2.674074 ] [ 1.919186 2.00454 4.634036 ] [ 0.9862405 4.087254 4.422598 ] [ 4.092598 2.125916 2.093906 ] [ 4.150721 2.426451 4.257829 ] [ 3.183229 4.446818 3.622817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.816977e-10 2.980856e-10 2.674074e-10 ] [ 1.919186e-10 2.00454e-10 4.634036e-10 ] [ 9.862405e-11 4.087254e-10 4.422598e-10 ] [ 4.092598e-10 2.125916e-10 2.093906e-10 ] [ 4.150721e-10 2.426451e-10 4.257829e-10 ] [ 3.183229e-10 4.446818000000001e-10 3.622817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6193833 -1.0136205 -3.8809485 ] [ -0.3958671 -2.0035446 1.97539 ] [ -0.6178366 1.1041593 1.0392416 ] [ -0.6246164 0.2775898 -0.8280895 ] [ 0.9508789 -0.1225056 1.532685 ] [ 1.3068244 1.7579216 0.1617214 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.92361450749812e-10 -1.623999080843397e-09 -6.217965004457349e-09 ] [ -6.342490177893414e-10 -3.210032343296876e-09 3.16492370103726e-09 ] [ -9.898833641500042e-10 1.769058230673796e-09 1.665048608600774e-09 ] [ -1.000745801293197e-09 4.447478913967331e-10 -1.326745647760743e-09 ] [ 1.523475955343622e-09 -1.962756098541504e-10 2.45563209428229e-09 ] [ 2.093763518421069e-09 2.816500911923894e-09 2.591062482977675e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.225601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.759845542880703e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4763862 2.3781315 2.4531537 ] [ 1.8533923 1.898023 4.7536488 ] [ 1.3498679 4.1211924 4.0688979 ] [ 3.7396001 2.8038744 2.1711013 ] [ 4.1166136 2.3237099 4.4715755 ] [ 3.6130915 4.5469039 3.7868827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4763862e-10 2.3781315e-10 2.4531537e-10 ] [ 1.8533923e-10 1.898023e-10 4.7536488e-10 ] [ 1.3498679e-10 4.1211924e-10 4.0688979e-10 ] [ 3.7396001e-10 2.8038744e-10 2.1711013e-10 ] [ 4.1166136e-10 2.3237099e-10 4.4715755e-10 ] [ 3.6130915e-10 4.5469039e-10 3.7868827e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.51e-05 3.13e-05 7.7e-06 ] [ 1.39e-05 -1.69e-05 -3.28e-05 ] [ 3.88e-05 -1.63e-05 2.74e-05 ] [ -1.84e-05 -2.33e-05 -3e-07 ] [ -4.37e-05 4.89e-05 2.28e-05 ] [ -1.56e-05 -2.36e-05 -2.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.02146335134e-14 5.014812864419999e-14 1.23367600818e-14 ] [ 2.22702552126e-14 -2.70767851146e-14 -5.255139359519999e-14 ] [ 6.21644533992e-14 -2.61154791342e-14 4.389963977159999e-14 ] [ -2.94800500656e-14 -3.733071557219999e-14 -4.806529901999999e-16 ] [ -7.001511890579999e-14 7.834643740259999e-14 3.65296272552e-14 ] [ -2.49939554904e-14 -3.78113685624e-14 -3.95737628598e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031399002736e-18 } }