{ "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" [ [ 2.742286 2.30018 2.898395 ] [ 1.359684 3.93311 2.87757 ] [ 2.145194 3.5026 4.929711 ] [ 3.276834 4.602113 2.280609 ] [ 3.311324 5.492688 4.465054 ] [ 4.684796 3.351118 3.565163 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.742286e-10 2.30018e-10 2.898395e-10 ] [ 1.359684e-10 3.93311e-10 2.87757e-10 ] [ 2.145194e-10 3.5026e-10 4.929711e-10 ] [ 3.276834e-10 4.602113e-10 2.280609e-10 ] [ 3.311324e-10 5.492688e-10 4.465054e-10 ] [ 4.684796000000001e-10 3.351118e-10 3.565163e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1620517 -4.6866949 -1.0873352 ] [ -6.2663555 0.0334898 -2.3193961 ] [ -3.601617 -1.3992936 6.989388 ] [ 2.715983 4.3188991 -5.7888237 ] [ 1.2587931 3.4473057 2.3987163 ] [ 5.7311446 -1.7137061 -0.1925493 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.596354451008953e-10 -7.508912997602594e-09 -1.742103036412892e-09 ] [ -1.003980827972149e-08 5.365657459526784e-11 -3.716082205794699e-09 ] [ -5.770426554475833e-09 -2.241915491555067e-09 1.119823404730007e-08 ] [ 4.351484465090247e-09 6.919639165614162e-09 -9.274717994072953e-09 ] [ 2.016808875244357e-09 5.523192597290578e-09 3.843167175791878e-09 ] [ 9.18230588854417e-09 -2.745659848342347e-09 -3.084979868114055e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.450957 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.674427897038611e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9358971 1.6204429 2.8879042 ] [ 1.5007502 3.5483217 2.895688 ] [ 1.3666474 4.2518583 5.1899146 ] [ 3.490086 5.0085094 2.5826609 ] [ 3.3287471 5.6920444 4.8811776 ] [ 4.8979902 3.0606323 2.5791567 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9358971e-10 1.6204429e-10 2.8879042e-10 ] [ 1.5007502e-10 3.5483217e-10 2.895688e-10 ] [ 1.3666474e-10 4.2518583e-10 5.1899146e-10 ] [ 3.490086e-10 5.0085094e-10 2.5826609e-10 ] [ 3.328747100000001e-10 5.692044400000001e-10 4.8811776e-10 ] [ 4.8979902e-10 3.0606323e-10 2.5791567e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 -1.55e-05 -4.4e-06 ] [ -1.8e-06 1.24e-05 -1.7e-06 ] [ 1.14e-05 4.8e-06 1.2e-06 ] [ -4e-06 -7.8e-06 4.7e-06 ] [ -9.1e-06 -1.2e-06 -2.7e-06 ] [ 5.5e-06 7.1e-06 2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 -2.48337376224e-14 -7.04957713152e-15 ] [ -2.88391791744e-15 1.986699009792e-14 -2.72370025536e-15 ] [ 1.826481347712e-14 7.69044777984e-15 1.92261194496e-15 ] [ -6.4087064832e-15 -1.249697764224e-14 7.53023011776e-15 ] [ -1.457980724928e-14 -1.92261194496e-15 -4.32587687616e-15 ] [ 8.8119714144e-15 1.137545400768e-14 4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.235572 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.76144305045151e-18 } }