{ "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" [ [ 2.69276 0.7489354 1.12344 ] [ 2.32609 2.279725 3.013569 ] [ 2.388377 0.2175567 3.770382 ] [ 2.168931 2.205605 5.63033 ] [ 4.69019 0.7206414 2.589749 ] [ 3.957875 2.675588 1.380487 ] [ 4.50812 1.505291 4.661584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.69276e-10 7.489354e-11 1.12344e-10 ] [ 2.32609e-10 2.279725e-10 3.013569e-10 ] [ 2.388377e-10 2.175567e-11 3.770382e-10 ] [ 2.168931e-10 2.205605e-10 5.63033e-10 ] [ 4.690190000000001e-10 7.206414e-11 2.589749e-10 ] [ 3.957875e-10 2.675588e-10 1.380487e-10 ] [ 4.50812e-10 1.505291e-10 4.661584000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2830572 -1.7831281 -0.1308107 ] [ -0.576883 4.5939379 0.8400278 ] [ 0.8181374 -3.7400201 1.587629 ] [ 0.8409934 -0.927885 -1.6181873 ] [ 0.1838671 -1.2864195 -2.4127591 ] [ 1.6738518 2.1869033 -2.3949913 ] [ -1.6569095 0.9566116 4.1290915 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.055684265925465e-09 -2.856886177248815e-09 -2.095818470171838e-10 ] [ -9.242684631518219e-10 7.360299961427029e-09 1.345872913070425e-09 ] [ 1.310800625681511e-09 -5.992172814910343e-09 2.543662087260785e-09 ] [ 1.347419974828216e-09 -1.48663566603909e-09 -2.592621881495548e-09 ] [ 2.945875713813414e-10 -2.061071264421963e-09 -3.865666253490869e-09 ] [ 2.681806242738841e-09 3.503805368077492e-09 -3.837199099493284e-09 ] [ -2.654661685552623e-09 1.532660753333354e-09 6.615533920948011e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.242084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.082921737426525e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3856447 0.7820371 1.4198337 ] [ 2.8075561 2.6268873 3.1523132 ] [ 2.5943302 0.062443 3.8096378 ] [ 1.930187 1.8630189 5.3740116 ] [ 4.685525 0.847736 2.5508581 ] [ 3.98976 2.5953554 0.9408403 ] [ 4.33934 1.5758649 4.9220463 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3856447e-10 7.820371000000001e-11 1.4198337e-10 ] [ 2.8075561e-10 2.6268873e-10 3.1523132e-10 ] [ 2.5943302e-10 6.2443e-12 3.8096378e-10 ] [ 1.930187e-10 1.8630189e-10 5.3740116e-10 ] [ 4.685525000000001e-10 8.47736e-11 2.5508581e-10 ] [ 3.98976e-10 2.5953554e-10 9.408403e-11 ] [ 4.33934e-10 1.5758649e-10 4.9220463e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 6.8e-06 -2.24e-05 ] [ -1.6e-05 1.08e-05 5.8e-06 ] [ -2.11e-05 -5e-06 1.31e-05 ] [ 2.6e-06 -2.31e-05 1.03e-05 ] [ 5.1e-06 -9e-07 3.6e-06 ] [ 1.86e-05 -8.8e-06 -1.49e-05 ] [ 1.85e-05 2.01e-05 4.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.23367600818e-14 1.08948011112e-14 -3.588875660159999e-14 ] [ -2.5634826144e-14 1.73035076472e-14 9.2926244772e-15 ] [ -3.38059269774e-14 -8.010883169999999e-15 2.09885139054e-14 ] [ 4.165659248399999e-15 -3.70102802454e-14 1.65024193302e-14 ] [ 8.1711008334e-15 -1.4419589706e-15 5.767835882399999e-15 ] [ 2.98004853924e-14 -1.40991543792e-14 -2.38724318466e-14 ] [ 2.9640267729e-14 3.22037503434e-14 7.209794853e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.591051 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.459267741570233e-18 } }