{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8888047 2.050538 1.655197 ] [ 2.913325 1.361036 3.047712 ] [ 2.022581 2.448681 4.72594 ] [ 1.815806 3.470528 2.839754 ] [ 4.233041 2.418243 4.364549 ] [ 4.034854 4.068796 2.809397 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.888047000000001e-11 2.050538e-10 1.655197e-10 ] [ 2.913325e-10 1.361036e-10 3.047712e-10 ] [ 2.022581e-10 2.448681e-10 4.72594e-10 ] [ 1.815806e-10 3.470528e-10 2.839754e-10 ] [ 4.233041e-10 2.418243e-10 4.364549e-10 ] [ 4.034854000000001e-10 4.068796e-10 2.809397e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.190753 -1.7381128 -0.479513 ] [ -1.4793907 -3.3452138 -2.659899 ] [ -1.5940011 0.0192096 2.1232123 ] [ -0.9975789 3.6837027 -0.5133886 ] [ 3.4620601 0.3978186 1.8546627 ] [ 0.4181576 0.9825956 -0.3250744 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.05619999465402e-10 -2.784763715416315e-09 -7.68264524299242e-10 ] [ -2.370245212096903e-09 -5.359623386094348e-09 -4.261628026599966e-09 ] [ -2.553871316990298e-09 3.07771722684864e-11 3.401761136081398e-09 ] [ -1.598297604151422e-09 5.901942392542712e-09 -8.225392190819723e-10 ] [ 5.546831797723703e-09 6.373756654905924e-10 2.971497241891351e-09 ] [ 6.699623360495184e-10 1.57429171099121e-09 -5.208266079915695e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.512246719227608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.164900596638963e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9625188 2.3289533 1.4533004 ] [ 2.6175373 0.9181578 3.207829 ] [ 1.9625369 2.4045219 5.0389127 ] [ 1.4609586 3.8753587 3.2831156 ] [ 4.2226437 2.474258 4.1482035 ] [ 3.6822164 3.8165723 2.3111877 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9625188e-10 2.3289533e-10 1.4533004e-10 ] [ 2.6175373e-10 9.181578e-11 3.207829e-10 ] [ 1.9625369e-10 2.4045219e-10 5.0389127e-10 ] [ 1.4609586e-10 3.8753587e-10 3.2831156e-10 ] [ 4.2226437e-10 2.474258e-10 4.1482035e-10 ] [ 3.6822164e-10 3.8165723e-10 2.3111877e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.22e-05 7.9e-06 3.21e-05 ] [ 3.85e-05 2.45e-05 2.33e-05 ] [ -2.84e-05 -2.88e-05 -3.93e-05 ] [ 3.48e-05 7.8e-06 7.1e-06 ] [ -2.99e-05 2.09e-05 -3.12e-05 ] [ 7.2e-06 -3.24e-05 8.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.55683212748e-14 1.26571954086e-14 5.14298699514e-14 ] [ 6.168380040899999e-14 3.925332753299999e-14 3.733071557219999e-14 ] [ -4.550181640559999e-14 -4.614268705919999e-14 -6.29655417162e-14 ] [ 5.575574686319999e-14 1.24969777452e-14 1.13754541014e-14 ] [ -4.790508135659999e-14 3.34854916506e-14 -4.998791098079999e-14 ] [ 1.15356717648e-14 -5.19105229416e-14 1.29776307354e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.509304719227607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.64508222647324e-18 } }