{ "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" [ [ 0.2519361 0.630526 0.2961672 ] [ 1.040527 1.338339 0.9480581 ] [ 1.471162 2.964903 0.310665 ] [ 0.0960364 2.590998 1.829013 ] [ 2.039261 0.0625187 0.2196196 ] [ 2.19391 1.549757 2.906446 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.519361e-11 6.30526e-11 2.961672e-11 ] [ 1.040527e-10 1.338339e-10 9.480581e-11 ] [ 1.471162e-10 2.964903e-10 3.10665e-11 ] [ 9.60364e-12 2.590998e-10 1.829013e-10 ] [ 2.039261e-10 6.25187e-12 2.196196e-11 ] [ 2.19391e-10 1.549757e-10 2.906446e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -64.7011206 -52.1873599 -45.8604983 ] [ 49.6142575 36.2817281 45.7424213 ] [ 8.3145101 19.6334499 -10.2696038 ] [ -12.6679933 12.4844209 13.3850748 ] [ 17.5603182 -15.0429209 -6.241498 ] [ 1.8800281 -1.1693181 3.244104 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.036626227648813e-07 -8.361336793305542e-08 -7.347661819449816e-08 ] [ 7.949080342485106e-08 5.812973652404241e-08 7.328743798564394e-08 ] [ 1.332131369562547e-08 3.14562544154281e-08 -1.645371911323884e-08 ] [ -2.029636269771104e-08 2.00022472902069e-08 2.144525391221924e-08 ] [ 2.813473127384874e-08 -2.41014161745237e-08 -9.999982174369959e-09 ] [ 3.012137068267045e-09 -1.873454122098276e-09 5.197627584243764e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 28.141331 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.508738260639429e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1103594 -0.235363 0.0800799 ] [ 1.7403399 1.3125511 0.8883032 ] [ 1.0016282 3.3956421 0.3587802 ] [ 0.5628779 3.7302195 2.5655071 ] [ 2.3712754 -0.7124962 -0.4767842 ] [ 1.3063518 1.6464882 3.0940827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.103594e-11 -2.35363e-11 8.00799e-12 ] [ 1.7403399e-10 1.3125511e-10 8.883032e-11 ] [ 1.0016282e-10 3.3956421e-10 3.587802e-11 ] [ 5.628779e-11 3.7302195e-10 2.5655071e-10 ] [ 2.3712754e-10 -7.124962e-11 -4.767842e-11 ] [ 1.3063518e-10 1.6464882e-10 3.0940827e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.46e-05 1.41e-05 -4.8e-06 ] [ 2.1e-06 -3.02e-05 -2.1e-06 ] [ -9.9e-06 -1.62e-05 -2.1e-06 ] [ 3.8e-06 1.34e-05 1.1e-06 ] [ -6.8e-06 1.25e-05 -3.6e-06 ] [ -3.7e-06 6.5e-06 1.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.339177866368e-14 2.259069035328e-14 -7.69044777984e-15 ] [ 3.36457090368e-15 -4.838573394816e-14 -3.36457090368e-15 ] [ -1.586154854592e-14 -2.595526125696e-14 -3.36457090368e-15 ] [ 6.08827115904e-15 2.146916671872e-14 1.76239428288e-15 ] [ -1.089480102144e-14 2.002720776e-14 -5.76783583488e-15 ] [ -5.928053496960001e-15 1.04141480352e-14 1.84250311392e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.9707731 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.597493955212154e-18 } }