{ "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" [ [ 2.61879 2.030613 1.31449 ] [ 0.5326459 2.599792 1.87087 ] [ 1.791863 1.569063 3.307142 ] [ 2.645053 4.244738 2.416375 ] [ 4.072939 1.030921 3.139936 ] [ 4.500349 3.153395 1.645552 ] [ 3.28786 3.426147 4.164789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61879e-10 2.030613e-10 1.31449e-10 ] [ 5.326459000000001e-11 2.599792e-10 1.87087e-10 ] [ 1.791863e-10 1.569063e-10 3.307142e-10 ] [ 2.645053e-10 4.244738e-10 2.416375e-10 ] [ 4.072939e-10 1.030921e-10 3.139936e-10 ] [ 4.500349e-10 3.153395e-10 1.645552e-10 ] [ 3.28786e-10 3.426147e-10 4.164789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4335738 -2.4555601 -7.3164523 ] [ -6.1339491 2.9426948 -2.1395963 ] [ 0.0118605 -1.8442913 9.0626623 ] [ -3.35606 5.1278239 -5.1724507 ] [ 2.4400321 2.4329237 -1.476411 ] [ 5.0228182 -1.5039625 1.0635954 ] [ 0.5817245 -4.6996286 5.9786526 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.296838445474589e-09 -3.934241015602703e-09 -1.172224891883556e-08 ] [ -9.827669922165328e-09 4.714716849553303e-09 -3.428011198052854e-09 ] [ 1.9002615967557e-11 -2.954880427149484e-09 1.45199857788927e-08 ] [ -5.377000914302039e-09 8.215679635846753e-09 -8.287179652056942e-09 ] [ 3.909362416829951e-09 3.897973504444825e-09 -2.365471206380574e-09 ] [ 8.047441956869937e-09 -2.409613575912225e-09 1.704067697909884e-09 ] [ 9.320254013253329e-10 -7.529635131398131e-09 9.578857498523349e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.533242 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.687611421266743e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2263932 2.2866948 0.1849828 ] [ 0.6430773 1.5703062 1.7193098 ] [ 1.591583 1.5273402 3.8469448 ] [ 3.8060549 4.7666566 2.7763513 ] [ 4.0474592 1.5533555 3.3729818 ] [ 4.1487326 2.8856038 1.3589964 ] [ 2.9861997 3.4647119 4.5995871 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2263932e-10 2.2866948e-10 1.849828e-11 ] [ 6.430773e-11 1.5703062e-10 1.7193098e-10 ] [ 1.591583e-10 1.5273402e-10 3.8469448e-10 ] [ 3.8060549e-10 4.766656600000001e-10 2.7763513e-10 ] [ 4.0474592e-10 1.5533555e-10 3.3729818e-10 ] [ 4.1487326e-10 2.8856038e-10 1.3589964e-10 ] [ 2.9861997e-10 3.4647119e-10 4.5995871e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.09e-05 2.83e-05 2.95e-05 ] [ 2.58e-05 -5.02e-05 -1.33e-05 ] [ -0.000154 -2.81e-05 -4.34e-05 ] [ -4.1e-06 -2.78e-05 1.17e-05 ] [ 5.69e-05 4.85e-05 2.92e-05 ] [ -1.83e-05 -4.2e-06 -1.98e-05 ] [ 0.0001047 3.35e-05 6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.74637253106e-14 4.53415987422e-14 4.726421070299999e-14 ] [ 4.133615715719999e-14 -8.04292670268e-14 -2.13089492322e-14 ] [ -2.467352016359999e-13 -4.50211634154e-14 -6.953446591559999e-14 ] [ -6.568924199399999e-15 -4.454051042519999e-14 1.87454666178e-14 ] [ 9.116385047459999e-14 7.770556674899999e-14 4.67835577128e-14 ] [ -2.93198324022e-14 -6.729141862799999e-15 -3.17230973532e-14 ] [ 1.677478935798e-13 5.367291723899999e-14 9.773277467399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.179115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.912615327979891e-18 } }