{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5978582 -0.0625447 -3.025844 ] [ -1.3879886 -0.7042676 0.9453444 ] [ -0.1548343 0.150701 -0.6206448 ] [ 0.0720573 0.7092643 5.5601418 ] [ 2.0686238 -0.093153 -2.8589975 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.578744384852988e-10 -1.002076569205398e-10 -4.847936554929096e-09 ] [ -2.223802903178372e-09 -1.128361092803258e-09 1.51460870876275e-09 ] [ -2.480718976017462e-10 2.41449620920434e-10 -9.94382596573603e-10 ] [ 1.154485223691282e-10 1.136366688790366e-09 8.9083292736867e-09 ] [ 3.314300716896289e-09 -1.49247559987002e-10 -4.580618991164414e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3378716 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.496091968881219e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3117539 2.7831163 0.5950067 ] [ 1.3749146 1.2070142 2.7199199 ] [ 2.6226596 4.6479994 1.9392908 ] [ 2.6857271 3.0719406 4.0642445 ] [ 3.5169887 2.2533076 1.7844534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3117539e-10 2.7831163e-10 5.950067e-11 ] [ 1.3749146e-10 1.2070142e-10 2.7199199e-10 ] [ 2.6226596e-10 4.6479994e-10 1.9392908e-10 ] [ 2.6857271e-10 3.0719406e-10 4.0642445e-10 ] [ 3.5169887e-10 2.2533076e-10 1.7844534e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.33e-05 8.9e-06 -1.3e-05 ] [ -3.34e-05 2.9e-06 2.65e-05 ] [ -1.07e-05 -1.58e-05 -2.3e-06 ] [ 1.51e-05 -3.18e-05 -5.21e-05 ] [ 4.23e-05 3.57e-05 4.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.13089492322e-14 1.42593720426e-14 -2.082829624199999e-14 ] [ -5.351269957559999e-14 4.6463122386e-15 4.2457680801e-14 ] [ -1.71432899838e-14 -2.53143908172e-14 -3.685006258199999e-15 ] [ 2.41928671734e-14 -5.09492169612e-14 -8.347340263139999e-14 ] [ 6.77720716182e-14 5.719770583379999e-14 6.552902433059999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.312806 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.8125113438175e-18 } }