{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.051773 2.11113 1.612774 ] [ 4.096623 0.6333142 0.1280934 ] [ 4.940584 2.852779 0.2569481 ] [ 3.858102 4.269978 1.799879 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.051773e-10 2.11113e-10 1.612774e-10 ] [ 4.096623e-10 6.333142000000001e-11 1.280934e-11 ] [ 4.940584000000001e-10 2.852779e-10 2.569481e-11 ] [ 3.858102e-10 4.269978e-10 1.799879e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5075899 -1.2627846 1.6557948 ] [ 0.2777551 -1.9257029 -0.9940797 ] [ 2.1812716 0.6958161 -1.6522136 ] [ 0.0485632 2.4926715 0.9904984 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.017601945434397e-09 -2.023203979895036e-09 2.652875739258703e-09 ] [ 4.450127311943333e-10 -3.085316190406038e-09 -1.59269126767373e-09 ] [ 3.494782389927794e-09 1.114820296981007e-09 -2.647138024297022e-09 ] [ 7.78068243122688e-11 3.993700033537731e-09 1.586953392494385e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.0682549 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.132459284393601e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6841109 1.9530891 1.8831432 ] [ 4.0861597 0.9400508 0.2481019 ] [ 5.2894348 2.9805092 0.0157092 ] [ 3.8873766 3.9935521 1.6507402 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6841109e-10 1.9530891e-10 1.8831432e-10 ] [ 4.0861597e-10 9.400508e-11 2.481019e-11 ] [ 5.2894348e-10 2.9805092e-10 1.57092e-12 ] [ 3.8873766e-10 3.9935521e-10 1.6507402e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.5e-06 9e-07 5e-07 ] [ 4e-06 6e-07 4.9e-06 ] [ 7e-07 5.3e-06 -6.6e-06 ] [ 4.8e-06 -6.9e-06 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.5220678023e-14 1.4419589706e-15 8.010883169999999e-16 ] [ 6.408706535999999e-15 9.613059803999998e-16 7.850665506599998e-15 ] [ 1.1215236438e-15 8.4915361602e-15 -1.05743657844e-14 ] [ 7.690447843199998e-15 -1.10550187746e-14 1.9226119608e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.6361973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383671352067389e-18 } }