{ "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" [ [ 0.7315436 0.3767612 1.166558 ] [ 0.6069044 0.5624824 2.9402 ] [ 2.192795 0.1872249 0.2922769 ] [ 2.54678 0.883358 1.224646 ] [ 2.591807 0.3326772 2.854818 ] [ 2.523994 2.504234 0.7585561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.315436e-11 3.767612e-11 1.166558e-10 ] [ 6.069044000000001e-11 5.624824e-11 2.9402e-10 ] [ 2.192795e-10 1.872249e-11 2.922769e-11 ] [ 2.54678e-10 8.83358e-11 1.224646e-10 ] [ 2.591807e-10 3.326772e-11 2.854818e-10 ] [ 2.523994e-10 2.504234e-10 7.585561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -402.1910434 -0.4719303 -7.040914 ] [ -41.6726615 25.8453073 204.2662297 ] [ -11796.8168778 -23897.8798183 -32149.7907191 ] [ 12212.752893 23525.7461963 31748.4035786 ] [ 37.007562 -119.9070182 339.1318913 ] [ -9.0798724 466.6672633 -134.9700666 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.443810868306382e-07 -7.561156933071303e-10 -1.128078779986341e-08 ] [ -6.676696398181225e-08 4.140874711345157e-08 3.272705776443026e-07 ] [ -1.890058420147001e-05 -3.828862433156841e-05 -5.150964305375485e-05 ] [ 1.956698716077216e-05 3.769240054258638e-05 5.086654996135597e-05 ] [ 5.929265062920649e-08 -1.921122212298801e-07 5.43349187608547e-07 ] [ -1.454755927912718e-08 7.476833789519779e-07 -2.162458852143389e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 4251.0011 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.810854577415084e-16 } "relaxed-configuration-positions" { "source-value" [ [ 0.9561799 0.1285897 1.2581356 ] [ 1.2880835 1.6581593 2.8267057 ] [ 2.4057164 0.4391672 -0.3789679 ] [ 3.0227952 0.8660384 1.6982223 ] [ 1.966812 -0.4311268 3.1404388 ] [ 1.554237 2.1859099 0.6925204 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.561799e-11 1.285897e-11 1.2581356e-10 ] [ 1.2880835e-10 1.6581593e-10 2.8267057e-10 ] [ 2.4057164e-10 4.391672e-11 -3.789679e-11 ] [ 3.0227952e-10 8.660384e-11 1.6982223e-10 ] [ 1.966812e-10 -4.311268e-11 3.1404388e-10 ] [ 1.554237e-10 2.1859099e-10 6.925204000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.08e-05 -1.5e-06 -3e-07 ] [ -1.47e-05 1.52e-05 3.85e-05 ] [ 2.33e-05 -9.2e-06 -4.17e-05 ] [ -9e-07 2.3e-06 -5.9e-06 ] [ 4.5e-06 1.68e-05 -9.2e-06 ] [ 8.6e-06 -2.35e-05 1.85e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.332527371264e-14 -2.4032649312e-15 -4.8065298624e-16 ] [ -2.355199632576e-14 2.435308463616e-14 6.16837999008e-14 ] [ 3.733071526464e-14 -1.474002491136e-14 -6.681076508736e-14 ] [ -1.44195895872e-15 3.68500622784e-15 -9.45284206272e-15 ] [ 7.2097947936e-15 2.691656722944e-14 -1.474002491136e-14 ] [ 1.377871893888e-14 -3.76511505888e-14 2.96402674848e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }