{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -18.2507526 1.4334275 -19.6392391 ] [ -4.8659055 -8.8909725 -0.3710129 ] [ -9.1809568 -1.1348918 18.7231791 ] [ 3.5534875 -7.9370603 -4.8758437 ] [ 15.0641892 -4.6017506 10.9590851 ] [ 3.010119 4.9409164 -7.4689272 ] [ 10.6698191 16.1903313 2.6727586 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.924092912772481e-08 2.296604028111792e-09 -3.146552973632124e-08 ] [ -7.796040031122135e-09 -1.424490827567573e-08 -5.944281943952084e-10 ] [ -1.470951434153478e-08 -1.818297109097629e-09 2.999783982107119e-08 ] [ 5.69331459480504e-09 -1.271657245053983e-08 -7.81196278281497e-09 ] [ 2.413549174754785e-08 -7.372817226072373e-09 1.755838993257763e-08 ] [ 4.822742287625875e-09 7.9162207414073e-09 -1.196654054229721e-08 ] [ 1.70949347101853e-08 2.593977029186647e-08 4.282231341962139e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.4227019 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.88159634334774e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7786175 2.8961308 1.1052093 ] [ 2.1828156 1.0785856 2.5459767 ] [ 2.5694267 2.1489322 4.7157495 ] [ 4.5965446 0.713775 2.3365912 ] [ 4.9300028 2.380146 4.1015326 ] [ 3.753032 4.2036392 0.9062565 ] [ 4.9903547 4.4178031 2.923843 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7786175e-10 2.8961308e-10 1.1052093e-10 ] [ 2.1828156e-10 1.0785856e-10 2.5459767e-10 ] [ 2.5694267e-10 2.1489322e-10 4.715749500000001e-10 ] [ 4.5965446e-10 7.137750000000001e-11 2.3365912e-10 ] [ 4.9300028e-10 2.380146e-10 4.1015326e-10 ] [ 3.753032e-10 4.2036392e-10 9.062565000000001e-11 ] [ 4.9903547e-10 4.4178031e-10 2.923843000000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.8e-06 1.13e-05 4.72e-05 ] [ -4.46e-05 8.3e-06 -5.27e-05 ] [ 2.4e-05 -2.17e-05 4e-06 ] [ 4.8e-06 -2.4e-06 -2.26e-05 ] [ 1.55e-05 4.31e-05 6.2e-05 ] [ 4.54e-05 -2.98e-05 1.38e-05 ] [ -4.97e-05 -8.6e-06 -5.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.69044777984e-15 1.810459581504e-14 7.562273650176e-14 ] [ -7.145707728768e-14 1.329806595264e-14 -8.443470791616e-14 ] [ 3.84522388992e-14 -3.476723267136e-14 6.4087064832e-15 ] [ 7.69044777984e-15 -3.84522388992e-15 -3.620919163008e-14 ] [ 2.48337376224e-14 6.905381235648e-14 9.93349504896e-14 ] [ 7.273881858432e-14 -4.774486329984001e-14 2.211003736704e-14 ] [ -7.962817805376001e-14 -1.377871893888e-14 -8.25120959712e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.090724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.738235842534546e-18 } }