{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8594843 0.7172344 0.0157799 ] [ 0.2882733 0.8856534 2.226981 ] [ 1.449769 2.87204 1.321697 ] [ 2.751005 0.6869835 1.2059 ] [ 2.852604 2.214321 2.896583 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.594843e-11 7.172344000000001e-11 1.57799e-12 ] [ 2.882733e-11 8.856534000000001e-11 2.226981e-10 ] [ 1.449769e-10 2.87204e-10 1.321697e-10 ] [ 2.751005e-10 6.869835e-11 1.2059e-10 ] [ 2.852604e-10 2.214321e-10 2.896583e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6046728 0.3345722 -0.6135092 ] [ 0.4392966 0.4533679 0.2329576 ] [ -0.9581978 -0.2651414 -0.799661 ] [ 0.7247393 -0.4124059 0.1542545 ] [ 0.3988348 -0.1103928 1.0259582 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.687926233936743e-10 5.360437568096218e-10 -9.829500968857113e-10 ] [ 7.038307421169292e-10 7.263754500011923e-10 3.732392203576781e-10 ] [ -1.535202113261994e-09 -4.248033522861812e-10 -1.281198158765549e-09 ] [ 1.161160362634957e-09 -6.607470912599828e-10 2.471429535531936e-10 ] [ 6.390037921214438e-10 -1.768687632646502e-10 1.643766241958051e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.522733 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.006363004112065e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0502628 1.0332568 -0.0321119 ] [ 0.691907 0.9417188 2.3324282 ] [ 0.9969943 3.0575496 1.2562972 ] [ 2.7576179 0.1597008 1.4109635 ] [ 2.7043536 2.1840063 2.6993639 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0502628e-10 1.0332568e-10 -3.21119e-12 ] [ 6.919070000000001e-11 9.417188e-11 2.3324282e-10 ] [ 9.969943000000001e-11 3.0575496e-10 1.2562972e-10 ] [ 2.7576179e-10 1.597008e-11 1.4109635e-10 ] [ 2.7043536e-10 2.1840063e-10 2.6993639e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.58e-05 -9.3e-06 1.68e-05 ] [ -7.9e-06 2.6e-05 1e-06 ] [ 1.11e-05 -3.42e-05 6.9e-06 ] [ -1.1e-05 4.24e-05 -1.24e-05 ] [ -8e-06 -2.49e-05 -1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.531439060864e-14 -1.490024257344e-14 2.691656722944e-14 ] [ -1.265719530432e-14 4.16565921408e-14 1.6021766208e-15 ] [ 1.778416049088e-14 -5.479444043136e-14 1.105501868352e-14 ] [ -1.76239428288e-14 6.793228872192001e-14 -1.986699009792e-14 ] [ -1.28174129664e-14 -3.989419785791999e-14 -1.970677243584e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137319633913408e-18 } }