{ "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" [ [ 2.735268 2.856882 0.3239211 ] [ 1.752307 5.080999 1.048158 ] [ 2.257155 3.165316 3.087528 ] [ 4.821596 2.368521 1.002197 ] [ 4.597336 2.893151 3.290106 ] [ 3.849033 4.748793 0.5493667 ] [ 3.5339 4.902962 2.909562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.735268e-10 2.856882e-10 3.239211e-11 ] [ 1.752307e-10 5.080999e-10 1.048158e-10 ] [ 2.257155e-10 3.165316e-10 3.087528e-10 ] [ 4.821596000000001e-10 2.368521e-10 1.002197e-10 ] [ 4.597336e-10 2.893151e-10 3.290106e-10 ] [ 3.849033e-10 4.748793e-10 5.493667e-11 ] [ 3.5339e-10 4.902962e-10 2.909562e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.262999 -1.1824603 0.2045596 ] [ -1.4040163 -0.3771961 1.0155047 ] [ -1.7304769 -1.6269221 -0.8983149 ] [ 0.7433399 0.352006 0.4524541 ] [ 0.6847276 -0.7434987 -0.0724544 ] [ 3.1424817 0.9092354 -0.308606 ] [ 0.8269428 2.6688359 -0.3931431 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.62572409069378e-09 -1.894510247684154e-09 3.277406086801997e-10 ] [ -2.249482091082119e-09 -6.043347728769388e-10 1.627017888652518e-09 ] [ -2.772529632014459e-09 -2.60661655248284e-09 -1.43925913089629e-09 ] [ 1.19096180908781e-09 5.639757835813248e-10 7.249113810051053e-10 ] [ 1.097054552336494e-09 -1.191216234735193e-09 -1.160847457540915e-10 ] [ 5.034810711031839e-09 1.456755700683736e-09 -4.944413182386048e-10 ] [ 1.32490842089889e-09 4.275946483731726e-09 -6.298846834488365e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -23.094918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.70021376788931e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5389754 2.7213594 0.4917971 ] [ 1.8194345 4.8988998 1.2908027 ] [ 2.1036306 3.05639 2.8471515 ] [ 4.862252 2.5687274 0.9808296 ] [ 4.4402002 2.8934926 3.2642441 ] [ 4.1087156 4.7713738 0.4903288 ] [ 3.6733867 5.1063811 2.845685 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5389754e-10 2.7213594e-10 4.917971e-11 ] [ 1.8194345e-10 4.8988998e-10 1.2908027e-10 ] [ 2.1036306e-10 3.05639e-10 2.8471515e-10 ] [ 4.862252e-10 2.5687274e-10 9.808296e-11 ] [ 4.4402002e-10 2.8934926e-10 3.2642441e-10 ] [ 4.1087156e-10 4.7713738e-10 4.903288000000001e-11 ] [ 3.6733867e-10 5.106381100000001e-10 2.845685e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.08e-05 -3.1e-06 -3e-06 ] [ 1e-07 6.6e-06 1.6e-06 ] [ -5.8e-06 -6.1e-06 -1.35e-05 ] [ 3.3e-06 -1.15e-05 7.7e-06 ] [ 1.89e-05 3e-07 -4e-07 ] [ 1e-07 -2e-07 -8.6e-06 ] [ -5.8e-06 1.39e-05 1.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.730350750464e-14 -4.96674752448e-15 -4.8065298624e-15 ] [ 1.6021766208e-16 1.057436569728e-14 2.56348259328e-15 ] [ -9.292624400640001e-15 -9.77327738688e-15 -2.16293843808e-14 ] [ 5.28718284864e-15 -1.84250311392e-14 1.233675998016e-14 ] [ 3.028113813312e-14 4.8065298624e-16 -6.408706483200001e-16 ] [ 1.6021766208e-16 -3.2043532416e-16 -1.377871893888e-14 ] [ -9.292624400640001e-15 2.227025502912e-14 2.611547891904e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.628085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.945854200207517e-18 } }