{ "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" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4518939 -1.4897168 0.9280523 ] [ -0.8479431 -0.2573899 -5.6919637 ] [ -6.5814309 -1.1207935 2.7250186 ] [ 2.2188114 6.2412685 2.6918592 ] [ -0.8298396 -7.7430541 -7.5004955 ] [ 2.0136864 3.8412432 -4.2483319 ] [ 4.4786096 0.5284426 11.095861 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.240138416621331e-10 -2.386789428572989e-09 1.486903697939668e-09 ] [ -1.358554610588676e-09 -4.1238408021005e-10 -9.119531166582265e-09 ] [ -1.05446147193907e-08 -1.795709142444605e-09 4.365961092165146e-09 ] [ 3.554927751044517e-09 9.999614474835485e-09 4.312833876725392e-09 ] [ -1.329549606134024e-09 -1.240574025260959e-08 -1.201711853451561e-08 ] [ 3.226281271702917e-09 6.154350049846979e-09 -6.806578047578844e-09 ] [ 7.17552359481044e-09 8.466583791547661e-10 1.777752908184651e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.098806 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.938442411279476e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1780734 1.8780492 3.6805583 ] [ 1.9458568 3.7079608 0.7355532 ] [ 1.0804753 3.9335905 2.9941639 ] [ 3.0083151 5.2523369 3.6615888 ] [ 3.5810717 1.9366691 1.5561809 ] [ 4.2183926 4.5269022 1.5416164 ] [ 4.3966579 3.1221883 3.8023005 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1780734e-10 1.8780492e-10 3.6805583e-10 ] [ 1.9458568e-10 3.7079608e-10 7.355532e-11 ] [ 1.0804753e-10 3.9335905e-10 2.9941639e-10 ] [ 3.0083151e-10 5.252336900000001e-10 3.6615888e-10 ] [ 3.5810717e-10 1.9366691e-10 1.5561809e-10 ] [ 4.2183926e-10 4.526902200000001e-10 1.5416164e-10 ] [ 4.3966579e-10 3.1221883e-10 3.8023005e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.7e-06 -3.34e-05 1.29e-05 ] [ -1.8e-06 -9e-07 -1.21e-05 ] [ -2.1e-06 3.1e-06 2.6e-06 ] [ 8.7e-06 2.05e-05 1.2e-06 ] [ -2.1e-06 1.5e-06 -1.21e-05 ] [ 4.9e-06 2e-06 -1.8e-06 ] [ 1e-06 7.2e-06 9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.393893660096e-14 -5.351269913472e-14 2.066807840832e-14 ] [ -2.88391791744e-15 -1.44195895872e-15 -1.938633711168e-14 ] [ -3.36457090368e-15 4.96674752448e-15 4.16565921408e-15 ] [ 1.393893660096e-14 3.28446207264e-14 1.92261194496e-15 ] [ -3.36457090368e-15 2.4032649312e-15 -1.938633711168e-14 ] [ 7.850665441919999e-15 3.2043532416e-15 -2.88391791744e-15 ] [ 1.6021766208e-15 1.153567166976e-14 1.457980724928e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.482183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.800954488314721e-18 } }