{ "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" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7721497 -5.5229285 -6.117708 ] [ -10.8906855 7.8793375 -5.4573009 ] [ -5.6277512 -6.3569535 6.1031336 ] [ 0.3132719 -0.2109634 -0.6959688 ] [ 11.2722635 -8.0850358 5.5071107 ] [ 4.4808894 5.5834331 -6.0592913 ] [ 4.2241615 6.7131107 6.7200246 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.043650059497734e-09 -8.848706921050012e-09 -9.801648730481127e-09 ] [ -1.744880169258556e-08 1.262409032989272e-08 -8.743559914650799e-09 ] [ -9.016651400319145e-09 -1.018496227721273e-08 9.778297967538939e-09 ] [ 5.019169141335955e-10 -3.380006273244787e-10 -1.115064940166231e-09 ] [ 1.806015704319718e-08 -1.295365533709102e-08 8.823364011697523e-09 ] [ 7.179176237070538e-09 8.945645976620869e-09 -9.70805485947684e-09 ] [ 6.767852797783459e-09 1.075558901638232e-08 1.076666630532087e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.8704355 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.996768028814358e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9239373 2.7348433 1.1865819 ] [ 1.5465984 5.120354 1.0799048 ] [ 2.2123602 2.2001766 3.526532 ] [ 4.3638055 3.1457291 1.0130701 ] [ 4.5091053 2.9534142 3.4816298 ] [ 3.9128142 5.5688744 1.2903055 ] [ 4.4329482 5.3643875 3.6423401 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9239373e-10 2.7348433e-10 1.1865819e-10 ] [ 1.5465984e-10 5.120354e-10 1.0799048e-10 ] [ 2.2123602e-10 2.2001766e-10 3.526532e-10 ] [ 4.3638055e-10 3.1457291e-10 1.0130701e-10 ] [ 4.5091053e-10 2.9534142e-10 3.4816298e-10 ] [ 3.9128142e-10 5.568874400000001e-10 1.2903055e-10 ] [ 4.4329482e-10 5.364387500000001e-10 3.6423401e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.4e-06 1.42e-05 8.6e-06 ] [ -2.9e-06 -6.7e-06 -1.6e-06 ] [ 4.4e-06 1.3e-06 -6.4e-06 ] [ 5.3e-06 -3.3e-06 -2.9e-06 ] [ -7.8e-06 3e-07 5.3e-06 ] [ -5.1e-06 -7e-07 4.5e-06 ] [ 1.8e-06 -5.1e-06 -7.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.04957713152e-15 2.275090801536e-14 1.377871893888e-14 ] [ -4.646312200320001e-15 -1.073458335936e-14 -2.56348259328e-15 ] [ 7.04957713152e-15 2.08282960704e-15 -1.025393037312e-14 ] [ 8.491536090240001e-15 -5.28718284864e-15 -4.646312200320001e-15 ] [ -1.249697764224e-14 4.8065298624e-16 8.491536090240001e-15 ] [ -8.17110076608e-15 -1.12152363456e-15 7.2097947936e-15 ] [ 2.88391791744e-15 -8.17110076608e-15 -1.2016324656e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.267203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.805204922840762e-18 } }