{ "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" [ [ 2.060429 2.678734 2.453953 ] [ 2.544795 1.257014 4.108114 ] [ 3.849483 1.551428 2.063601 ] [ 4.178567 2.654376 4.014408 ] [ 4.257126 3.923601 2.295059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.060429e-10 2.678734e-10 2.453953e-10 ] [ 2.544795e-10 1.257014e-10 4.108114e-10 ] [ 3.849483e-10 1.551428e-10 2.063601e-10 ] [ 4.178567e-10 2.654376e-10 4.014408000000001e-10 ] [ 4.257126000000001e-10 3.923601e-10 2.295059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.7227381 3.5920155 -3.9134905 ] [ -5.338817 -5.8711756 7.2880296 ] [ 5.1902144 -8.2518793 -9.8807989 ] [ 6.8626704 2.6613229 9.8208614 ] [ 3.0086702 7.8697165 -3.3146016 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.557754380232155e-08 5.755043303065826e-09 -6.270103036480977e-09 ] [ -8.553727850601978e-09 -9.40666036043093e-09 1.167671073302036e-08 ] [ 8.315640237130329e-09 -1.322096820104828e-08 -1.58307851228329e-08 ] [ 1.099521016172343e-08 4.263909365909119e-09 1.573475466083253e-08 ] [ 4.820421093852106e-09 1.260867589250426e-08 -5.310577234539014e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.745553 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.72162739360086e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0453567 3.0063715 2.6867785 ] [ 2.454392 0.8705826 4.0389009 ] [ 3.9775029 1.4182127 2.0546195 ] [ 4.1113798 2.8145078 4.2196826 ] [ 4.3017687 3.9554783 1.9351536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0453567e-10 3.0063715e-10 2.6867785e-10 ] [ 2.454392e-10 8.705826e-11 4.0389009e-10 ] [ 3.9775029e-10 1.4182127e-10 2.0546195e-10 ] [ 4.1113798e-10 2.8145078e-10 4.2196826e-10 ] [ 4.3017687e-10 3.9554783e-10 1.9351536e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.7e-06 -1.3e-06 -5.1e-06 ] [ -4.5e-06 -5.3e-06 2e-07 ] [ -2.2e-06 -1.5e-06 -1.6e-06 ] [ 9.7e-06 1.7e-06 1.46e-05 ] [ 1.7e-06 6.4e-06 -8.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.530230179799999e-15 -2.0828296242e-15 -8.1711008334e-15 ] [ -7.209794853e-15 -8.4915361602e-15 3.204353268e-16 ] [ -3.5247885948e-15 -2.403264951e-15 -2.5634826144e-15 ] [ 1.55411133498e-14 2.7237002778e-15 2.33917788564e-14 ] [ 2.7237002778e-15 1.02539304576e-14 -1.29776307354e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.582415215248651e-18 } }