{ "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" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3635397 -2.5967873 -4.3034521 ] [ -0.6901944 -0.5530858 0.235495 ] [ 2.9427406 -1.7248967 2.5120549 ] [ -2.7567418 2.1087236 -1.493772 ] [ 1.8427451 0.3685127 -1.4512041 ] [ -0.9136069 -1.9431667 3.2795691 ] [ 1.9385971 4.3407002 1.2213092 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.786808049672646e-09 -4.160511901250355e-09 -6.894890343352665e-09 ] [ -1.105813331487084e-09 -8.861411380564646e-10 3.77304583315296e-10 ] [ 4.714790190398964e-09 -2.763589166035071e-09 4.024755630946082e-09 ] [ -4.416787261542109e-09 3.378547651649211e-09 -2.393286575205658e-09 ] [ 2.952403117313758e-09 5.904224324078842e-10 -2.325085281029105e-09 ] [ -1.463759615781563e-09 -3.113296257057087e-09 5.254448938318097e-09 ] [ 3.10597495077068e-09 6.954568378341884e-09 1.956753047007952e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.684132 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.993527947034115e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5314615 2.8319332 1.0041024 ] [ 1.3394557 2.032643 2.8669316 ] [ 3.5511194 3.5772999 4.8374674 ] [ 1.5089678 4.188674 3.7903335 ] [ 4.5736122 2.2205592 2.0512379 ] [ 3.3779525 1.4223623 3.9121932 ] [ 3.5912439 4.3947173 2.543094 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5314615e-10 2.8319332e-10 1.0041024e-10 ] [ 1.3394557e-10 2.032643e-10 2.8669316e-10 ] [ 3.5511194e-10 3.5772999e-10 4.837467400000001e-10 ] [ 1.5089678e-10 4.188674e-10 3.7903335e-10 ] [ 4.573612200000001e-10 2.2205592e-10 2.0512379e-10 ] [ 3.3779525e-10 1.4223623e-10 3.9121932e-10 ] [ 3.5912439e-10 4.3947173e-10 2.543094e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.8e-06 -1.2e-06 -2.7e-06 ] [ 3e-07 -7e-07 -4e-07 ] [ -1e-06 7e-07 9e-07 ] [ 5e-06 2e-07 -3.1e-06 ] [ -1.5e-06 2.7e-06 -0.0 ] [ 6e-07 1e-07 9e-07 ] [ -5e-07 -1.8e-06 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.48609453824e-15 -1.92261194496e-15 -4.32587687616e-15 ] [ 4.8065298624e-16 -1.12152363456e-15 -6.408706483200001e-16 ] [ -1.6021766208e-15 1.12152363456e-15 1.44195895872e-15 ] [ 8.010883104e-15 3.2043532416e-16 -4.96674752448e-15 ] [ -2.4032649312e-15 4.32587687616e-15 0.0 ] [ 9.6130597248e-16 1.6021766208e-16 1.44195895872e-15 ] [ -8.010883104e-16 -2.88391791744e-15 7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.906032 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.669950894569667e-18 } }