{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7520329 -12.8808129 -11.9692907 ] [ 4.5176805 -4.9771579 4.0325307 ] [ 1.3399471 6.4300391 -2.3544602 ] [ -10.5565174 10.8572008 6.1191397 ] [ 2.3579015 -3.0997427 1.087205 ] [ 0.1261142 3.7130685 -3.7801511 ] [ 2.966907 -0.0425947 6.8650267 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.204889540379258e-09 -2.063733745530578e-08 -1.91769178850935e-08 ] [ 7.238122136977436e-09 -7.974286091108508e-09 6.460826463427663e-09 ] [ 2.146831934416061e-09 1.030205840172639e-08 -3.772261118122967e-09 ] [ -1.691340551469443e-08 1.73951534324061e-08 9.803942647521769e-09 ] [ 3.77777468857355e-09 -4.966335325352072e-09 1.74189444736797e-09 ] [ 2.020572244556028e-10 5.948991591141428e-09 -6.056469765409397e-09 ] [ 4.753509070651038e-09 -6.82442330722398e-11 1.099898537052613e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0280921 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.055891676219992e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6929396 1.5032305 2.4266792 ] [ 2.1715956 1.7692258 4.7575649 ] [ 3.2978804 4.3676317 3.4379719 ] [ 1.0441935 4.0502768 4.5886328 ] [ 5.2115267 1.2490477 2.7364159 ] [ 2.6556182 3.6685336 1.0591261 ] [ 4.4714021 2.6945109 4.7025288 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6929396e-10 1.5032305e-10 2.4266792e-10 ] [ 2.1715956e-10 1.7692258e-10 4.7575649e-10 ] [ 3.2978804e-10 4.3676317e-10 3.4379719e-10 ] [ 1.0441935e-10 4.0502768e-10 4.5886328e-10 ] [ 5.2115267e-10 1.2490477e-10 2.7364159e-10 ] [ 2.6556182e-10 3.6685336e-10 1.0591261e-10 ] [ 4.4714021e-10 2.6945109e-10 4.7025288e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.1e-06 2.31e-05 4.76e-05 ] [ -5.1e-06 6e-06 4.2e-06 ] [ 2.5e-06 -4.42e-05 2.29e-05 ] [ 4.3e-06 -1.03e-05 2.3e-06 ] [ 1.18e-05 -5.9e-06 -4e-06 ] [ -3e-06 2.28e-05 -5.49e-05 ] [ -1.76e-05 8.4e-06 -1.81e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.13754541014e-14 3.70102802454e-14 7.62636077784e-14 ] [ -8.1711008334e-15 9.613059803999999e-15 6.729141862799999e-15 ] [ 4.005441585e-15 -7.08162072228e-14 3.66898449186e-14 ] [ 6.8893595262e-15 -1.65024193302e-14 3.685006258199999e-15 ] [ 1.89056842812e-14 -9.452842140600001e-15 -6.408706535999999e-15 ] [ -4.806529901999999e-15 3.65296272552e-14 -8.795949720659999e-14 ] [ -2.81983087584e-14 1.34582837256e-14 -2.899939707539999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.707273 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.997235568645908e-18 } }