{ "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" [ [ 2.510917 2.898515 1.87318 ] [ 1.068289 2.930408 3.679489 ] [ 1.738918 4.773151 2.611531 ] [ 3.136153 2.016935 3.60422 ] [ 3.930075 4.659698 3.066974 ] [ 4.662989 3.229538 1.53666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.510917e-10 2.898515000000001e-10 1.87318e-10 ] [ 1.068289e-10 2.930408e-10 3.679489e-10 ] [ 1.738918e-10 4.773151000000001e-10 2.611531e-10 ] [ 3.136153000000001e-10 2.016935e-10 3.604220000000001e-10 ] [ 3.930075e-10 4.659698e-10 3.066974e-10 ] [ 4.662989e-10 3.229538e-10 1.53666e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9842363 0.0148954 -7.9096895 ] [ -1.6173346 -0.5661084 1.1580825 ] [ -1.4879285 3.8873448 0.2964101 ] [ 6.2244577 -0.080902 3.1530485 ] [ -0.3346869 -0.9821666 1.6739539 ] [ 1.1997286 -2.2730632 1.6281945 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.383450251602695e-09 2.386506163746432e-11 -1.267271959468724e-08 ] [ -2.591255684130919e-09 -9.070056433184947e-10 1.855452706457616e-09 ] [ -2.383924256122013e-09 6.228212955548453e-09 4.749013323889902e-10 ] [ 9.972680604098541e-09 -1.296192929759616e-10 5.05174059094851e-09 ] [ -5.362275264680276e-10 -1.573604364250625e-09 2.681969802876982e-09 ] [ 1.922177114225115e-09 -3.641848716640835e-09 2.608655162015145e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.643573 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.467682665117812e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0482717 2.456968 1.6120305 ] [ 1.5413236 3.2775923 3.7726415 ] [ 2.1478133 4.780371 2.0485514 ] [ 3.5346337 2.0557107 3.4087999 ] [ 3.6341754 4.3791136 3.8453208 ] [ 4.1411233 3.5584893 1.6847099 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0482717e-10 2.456968e-10 1.6120305e-10 ] [ 1.5413236e-10 3.2775923e-10 3.7726415e-10 ] [ 2.1478133e-10 4.780370999999999e-10 2.0485514e-10 ] [ 3.5346337e-10 2.0557107e-10 3.4087999e-10 ] [ 3.6341754e-10 4.379113600000001e-10 3.8453208e-10 ] [ 4.1411233e-10 3.5584893e-10 1.6847099e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-06 -1.2e-06 -1.4e-06 ] [ -1.2e-06 -2e-07 3e-07 ] [ -1.1e-06 1.1e-06 -7e-07 ] [ 9e-07 -3.2e-06 2.3e-06 ] [ 1e-06 2.1e-06 2.3e-06 ] [ 3.4e-06 1.4e-06 -2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-15 -1.92261194496e-15 -2.24304726912e-15 ] [ -1.92261194496e-15 -3.2043532416e-16 4.8065298624e-16 ] [ -1.76239428288e-15 1.76239428288e-15 -1.12152363456e-15 ] [ 1.44195895872e-15 -5.126965186560001e-15 3.68500622784e-15 ] [ 1.6021766208e-15 3.36457090368e-15 3.68500622784e-15 ] [ 5.44740051072e-15 2.24304726912e-15 -4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -26.519951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.248964547696158e-18 } }