{ "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" [ [ 1.2662929 -0.1986688 -0.0916954 ] [ -3.0571065 1.1892972 -0.6220443 ] [ -0.98601 -0.9354826 0.5252189 ] [ -2.0611571 1.0074054 1.5570495 ] [ 2.1017305 -0.8239293 -0.520237 ] [ 2.1546349 -0.3766283 -0.8324918 ] [ 0.5816152 0.1380064 -0.0158 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.028824896180098e-09 -3.183025092648192e-10 -1.469122273252836e-10 ] [ -4.898024601949521e-09 1.905464184721624e-09 -9.96624842772886e-10 ] [ -1.57976218289034e-09 -1.498808363233568e-09 8.414934493151826e-10 ] [ -3.302337744623201e-09 1.614041392845423e-09 2.494668326881383e-09 ] [ 3.367343498065137e-09 -1.320080272527976e-09 -8.335115655422579e-10 ] [ 3.452105691580926e-09 -6.034250619631421e-10 -1.333798909956601e-09 ] [ 9.318502834192367e-10 2.211106294224576e-10 -2.53143908172e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -21.36136 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.422467186246224e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1716105 2.7890113 0.9566539 ] [ 1.8438985 4.871762 2.1657122 ] [ 2.1230511 2.7402923 3.2996271 ] [ 4.4776388 3.0647556 1.0026335 ] [ 4.428734 3.0160545 3.3607831 ] [ 3.952462 5.3271039 1.0459837 ] [ 3.904174 5.2787994 3.3889707 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1716105e-10 2.7890113e-10 9.566538999999999e-11 ] [ 1.8438985e-10 4.871762000000001e-10 2.1657122e-10 ] [ 2.1230511e-10 2.7402923e-10 3.2996271e-10 ] [ 4.4776388e-10 3.0647556e-10 1.0026335e-10 ] [ 4.428734e-10 3.0160545e-10 3.3607831e-10 ] [ 3.952462e-10 5.3271039e-10 1.0459837e-10 ] [ 3.904174e-10 5.2787994e-10 3.3889707e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.28e-05 -3.67e-05 -2.26e-05 ] [ -1.78e-05 2.45e-05 -3.93e-05 ] [ -1.63e-05 -9e-06 -7e-06 ] [ -1.56e-05 -2.6e-06 -1.25e-05 ] [ 5.2e-05 -1.12e-05 2.36e-05 ] [ -1.05e-05 4e-07 2.61e-05 ] [ 3.1e-05 3.45e-05 3.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.65296272552e-14 -5.879988246779999e-14 -3.62091919284e-14 ] [ -2.851874408519999e-14 3.925332753299999e-14 -6.29655417162e-14 ] [ -2.61154791342e-14 -1.4419589706e-14 -1.1215236438e-14 ] [ -2.49939554904e-14 -4.165659248399999e-15 -2.0027207925e-14 ] [ 8.331318496799998e-14 -1.79443783008e-14 3.78113685624e-14 ] [ -1.6822854657e-14 6.408706536e-16 4.18168101474e-14 ] [ 4.966747565399999e-14 5.527509387299999e-14 5.06287816344e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993289292598e-18 } }