{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2656608 3.6634721 0.9350736 ] [ -1.9029107 0.9117487 2.7126713 ] [ 3.6762332 -0.5118855 1.4101521 ] [ -1.9110296 0.9592216 0.8268284 ] [ 2.0983372 0.7086194 -2.4993331 ] [ 1.7583403 -2.2142048 -4.2042185 ] [ 0.5466904 -3.5169715 0.8188261 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.834342006023025e-09 5.86952934957308e-09 1.498153060647291e-09 ] [ -3.048799035010163e-09 1.460782451184793e-09 4.346178536775143e-09 ] [ 5.889974885648771e-09 -8.201309806265184e-10 2.259312726392024e-09 ] [ -3.061806946776776e-09 1.536842421686369e-09 1.324725131893471e-09 ] [ 3.361906804394934e-09 1.135333435725323e-09 -4.004373060411589e-09 ] [ 2.817171720070458e-09 -3.54754716422314e-09 -6.735900589434844e-09 ] [ 8.758945776958003e-10 -5.634809513319907e-09 1.311904033920843e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.575504 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.418082781557689e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7584744 5.3136462 2.9205384 ] [ 5.6621046 3.0942505 1.4370072 ] [ 3.4334964 3.025207 2.4218216 ] [ 5.3848637 2.5007633 3.785071 ] [ 4.0389048 4.8327088 0.9026959 ] [ 5.1403728 4.8203093 3.0770777 ] [ 3.5903232 3.8724249 4.701943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7584744e-10 5.3136462e-10 2.9205384e-10 ] [ 5.6621046e-10 3.0942505e-10 1.4370072e-10 ] [ 3.4334964e-10 3.025207e-10 2.4218216e-10 ] [ 5.3848637e-10 2.5007633e-10 3.785071e-10 ] [ 4.0389048e-10 4.8327088e-10 9.026959e-11 ] [ 5.1403728e-10 4.8203093e-10 3.0770777e-10 ] [ 3.5903232e-10 3.8724249e-10 4.701943e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.26e-05 -2.46e-05 -5e-07 ] [ -2.23e-05 1.19e-05 -2.5e-06 ] [ 2.91e-05 4.49e-05 2.15e-05 ] [ -5.1e-06 1.15e-05 -2.08e-05 ] [ 1.62e-05 -2.9e-05 2.34e-05 ] [ -3.99e-05 -2.31e-05 6e-06 ] [ -6e-07 8.4e-06 -2.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.620919163008e-14 -3.941354487168e-14 -8.010883104e-16 ] [ -3.572853864384e-14 1.906590178752e-14 -4.005441552e-15 ] [ 4.662333966527999e-14 7.193773027392e-14 3.44467973472e-14 ] [ -8.17110076608e-15 1.84250311392e-14 -3.332527371264e-14 ] [ 2.595526125696e-14 -4.64631220032e-14 3.749093292672001e-14 ] [ -6.392684716992e-14 -3.701027994048e-14 9.6130597248e-15 ] [ -9.6130597248e-16 1.345828361472e-14 -4.341898642368e-14 ] ] } "relaxed-potential-energy" { "source-value" -31.275942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.010958306589679e-18 } }