{ "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" [ [ 2.028824879465032e-09 -3.18302506642391e-10 -1.469122261149043e-10 ] [ -4.898024561595715e-09 1.905464169022902e-09 -9.966248345619013e-10 ] [ -1.579762169875008e-09 -1.498808350885198e-09 8.414934423822933e-10 ] [ -3.302337717415928e-09 1.614041379547672e-09 2.494668306328329e-09 ] [ 3.367343470322294e-09 -1.320080261652109e-09 -8.335115586751296e-10 ] [ 3.452105663139746e-09 -6.034250569916487e-10 -1.333798898967709e-09 ] [ 9.318502757419162e-10 2.211106276007731e-10 -2.531439060864e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -21.36136 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.422467158049229e-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" [ [ -3.652962695424e-14 -5.879988198335999e-14 -3.620919163008e-14 ] [ -2.851874385024e-14 3.92533272096e-14 -6.296554119743999e-14 ] [ -2.611547891904e-14 -1.44195895872e-14 -1.12152363456e-14 ] [ -2.499395528448e-14 -4.16565921408e-15 -2.002720776e-14 ] [ 8.33131842816e-14 -1.794437815296e-14 3.781136825088e-14 ] [ -1.68228545184e-14 6.408706483200001e-16 4.181680980288e-14 ] [ 4.96674752448e-14 5.52750934176e-14 5.062878121728e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993258982137e-18 } }