{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2632029 -2.2089407 -4.4276718 ] [ 1.5095087 4.4234619 -0.1642579 ] [ -4.3299548 -1.1460756 -0.4786571 ] [ 0.3403991 -1.2898783 -1.2135376 ] [ 3.0334095 -2.3399946 4.6825833 ] [ -1.4202103 2.4205244 0.2951275 ] [ 2.1300507 0.1409029 1.3064138 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.02387415370676e-09 -3.539113146273586e-09 -7.093912242535453e-09 ] [ 2.418499548034201e-09 7.087167239179548e-09 -2.631701671617043e-10 ] [ -6.937352349680741e-09 -1.836215531989333e-09 -7.668932149999277e-10 ] [ 5.453794797613613e-10 -2.066612855937249e-09 -1.944301571181742e-09 ] [ 4.860057782212617e-09 -3.749084640918247e-09 7.502325488208513e-09 ] [ -2.275427739279354e-09 3.878107603755948e-09 4.728463806551519e-10 ] [ 3.412717432658675e-09 2.257513321829203e-10 2.093105647450487e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.801984 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.691974594785567e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.546305 1.6215579 2.4275926 ] [ 2.4544888 4.7341641 3.9520117 ] [ 0.9297159 3.2787256 2.8892509 ] [ 3.9926757 2.8785101 1.0021516 ] [ 3.665512 2.6138315 4.4116369 ] [ 3.925394 5.1590784 2.1190678 ] [ 5.4450237 3.3661224 2.9827716 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.546305e-10 1.6215579e-10 2.4275926e-10 ] [ 2.4544888e-10 4.7341641e-10 3.9520117e-10 ] [ 9.297159e-11 3.2787256e-10 2.8892509e-10 ] [ 3.9926757e-10 2.8785101e-10 1.0021516e-10 ] [ 3.665512e-10 2.6138315e-10 4.411636900000001e-10 ] [ 3.925394e-10 5.1590784e-10 2.1190678e-10 ] [ 5.4450237e-10 3.3661224e-10 2.9827716e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 -1.77e-05 -1.94e-05 ] [ -1.92e-05 4.06e-05 1e-06 ] [ -9.6e-06 2.6e-06 -6.1e-06 ] [ -6.9e-06 -4.3e-06 -1.08e-05 ] [ 3.56e-05 -2.75e-05 3.19e-05 ] [ 2.9e-06 8.6e-06 -3.6e-06 ] [ -8e-07 -2.4e-06 7.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 -2.835852618816e-14 -3.108222644352e-14 ] [ -3.076179111936e-14 6.504837080448e-14 1.6021766208e-15 ] [ -1.538089555968e-14 4.16565921408e-15 -9.77327738688e-15 ] [ -1.105501868352e-14 -6.889359469440001e-15 -1.730350750464e-14 ] [ 5.703748770048e-14 -4.4059857072e-14 5.110943420352001e-14 ] [ 4.646312200320001e-15 1.377871893888e-14 -5.76783583488e-15 ] [ -1.28174129664e-15 -3.84522388992e-15 1.137545400768e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.439394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.11453425893198e-18 } }