{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2482594 0.208506 0.7144033 ] [ 0.1842271 0.5542422 2.415306 ] [ 0.3347056 2.949491 0.3757933 ] [ 2.042519 0.2544893 1.784175 ] [ 2.203059 1.053322 2.694572 ] [ 1.978392 2.822156 1.26577 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.482594e-11 2.08506e-11 7.144033e-11 ] [ 1.842271e-11 5.542422e-11 2.415306e-10 ] [ 3.347056e-11 2.949491e-10 3.757933e-11 ] [ 2.042519e-10 2.544893e-11 1.784175e-10 ] [ 2.203059e-10 1.053322e-10 2.694572e-10 ] [ 1.978392e-10 2.822156e-10 1.26577e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -23.9224152 -9.2353263 -48.2041911 ] [ -20.7131285 4.4332982 29.9609839 ] [ -11.5820127 -2.3224586 -6.3899388 ] [ 2.2642186 -90.5883347 -102.0097011 ] [ 42.1419953 96.307671 122.2584123 ] [ 11.8113425 1.4051504 4.3844349 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.832793466228643e-08 -1.479662400522567e-08 -7.723162864129075e-08 ] [ -3.318609049973947e-08 7.102926787594258e-09 4.800278833623019e-08 ] [ -1.855643012263125e-08 -3.720988902352352e-09 -1.023781063805e-08 ] [ 3.627678135188192e-09 -1.451385131693114e-07 -1.634375595437441e-07 ] [ 6.751892017979782e-08 1.543019001511594e-07 1.958795714969982e-07 ] [ 1.892385696967114e-08 2.251299138135753e-09 7.024639150074125e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 45.335003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.26346825089199e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0141953 0.5225886 0.4587643 ] [ 0.1278109 0.227043 2.9756672 ] [ 0.4767261 2.7448701 -0.0599431 ] [ 2.0625176 -0.5592457 1.4381367 ] [ 2.3168823 1.508653 2.8877555 ] [ 2.0214205 3.3982975 1.5496389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.41953e-12 5.225886e-11 4.587643e-11 ] [ 1.278109e-11 2.27043e-11 2.9756672e-10 ] [ 4.767261e-11 2.7448701e-10 -5.99431e-12 ] [ 2.0625176e-10 -5.592457e-11 1.4381367e-10 ] [ 2.3168823e-10 1.508653e-10 2.8877555e-10 ] [ 2.0214205e-10 3.3982975e-10 1.5496389e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.87e-05 -3.03e-05 2.16e-05 ] [ 2.92e-05 -1.48e-05 -5e-05 ] [ 2.25e-05 4.45e-05 3.4e-06 ] [ -1.6e-05 2.38e-05 3.4e-05 ] [ 1.04e-05 -1.01e-05 1.88e-05 ] [ -1.74e-05 -1.31e-05 -2.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.598246939579999e-14 -4.854595201019999e-14 3.46070152944e-14 ] [ 4.67835577128e-14 -2.37122141832e-14 -8.010883169999999e-14 ] [ 3.6048974265e-14 7.129686021299999e-14 5.4474005556e-15 ] [ -2.5634826144e-14 3.81318038892e-14 5.447400555599999e-14 ] [ 1.66626369936e-14 -1.61819840034e-14 3.012092071919999e-14 ] [ -2.78778734316e-14 -2.09885139054e-14 -4.454051042519999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.424762 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.311101662741111e-18 } }