{ "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" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.4828494 -0.1380458 4.7375938 ] [ 0.7286951 -0.8752748 -0.0126408 ] [ -3.4712189 3.1471505 -4.23232 ] [ 5.6641641 -4.8866969 -3.4489227 ] [ 1.4427386 -0.063001 2.1855363 ] [ -0.3352765 1.3533469 -2.7356685 ] [ 2.4537469 1.4625211 3.5064219 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.038666974484731e-08 -2.211737533596326e-10 7.590462025207031e-09 ] [ 1.167498252911518e-09 -1.402344821335396e-09 -2.025279422820864e-11 ] [ -5.561505767259094e-09 5.042290953239031e-09 -6.780924155744256e-09 ] [ 9.074991297394673e-09 -7.829351526115835e-09 -5.525783316886412e-09 ] [ 2.311522054845723e-09 -1.009387292870208e-10 3.501615163769735e-09 ] [ -5.371721698036512e-10 2.168300763012156e-09 -4.383024112959005e-09 ] [ 3.931335916540476e-09 2.343217113846699e-09 5.617907190841116e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.120982 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.422648384393763e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.774234 2.3432868 4.1452726 ] [ 1.6891961 3.9658078 2.8359597 ] [ 3.2278362 3.9877454 1.0593789 ] [ 4.1899642 2.0371518 2.1757804 ] [ 4.7004407 3.2871745 5.1059942 ] [ 5.19333 5.074197 1.7526636 ] [ 5.9989177 3.3632847 3.1483657 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.774234e-10 2.3432868e-10 4.1452726e-10 ] [ 1.6891961e-10 3.9658078e-10 2.8359597e-10 ] [ 3.2278362e-10 3.9877454e-10 1.0593789e-10 ] [ 4.1899642e-10 2.0371518e-10 2.1757804e-10 ] [ 4.7004407e-10 3.2871745e-10 5.1059942e-10 ] [ 5.193329999999999e-10 5.074197e-10 1.7526636e-10 ] [ 5.9989177e-10 3.3632847e-10 3.1483657e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.61e-05 4.36e-05 -7.11e-05 ] [ -1e-05 -2.95e-05 4.85e-05 ] [ 8.11e-05 1.24e-05 2.19e-05 ] [ -3.33e-05 1.58e-05 3.74e-05 ] [ -5.24e-05 1e-07 3.6e-06 ] [ -3.66e-05 -4.86e-05 8.1e-06 ] [ -1.49e-05 6.2e-06 -4.84e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.0590387463488e-13 6.985490066688e-14 -1.1391475773888e-13 ] [ -1.6021766208e-14 -4.72642103136e-14 7.77055661088e-14 ] [ 1.2993652394688e-13 1.986699009792e-14 3.508766799552e-14 ] [ -5.335248147264001e-14 2.531439060864e-14 5.992140561792e-14 ] [ -8.395405492992e-14 1.6021766208e-16 5.76783583488e-15 ] [ -5.863966432128e-14 -7.786578377088e-14 1.297763062848e-14 ] [ -2.387243164992e-14 9.93349504896e-15 -7.754534844671999e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.352882 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.100673508550115e-18 } }