{ "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" [ [ 2.619068 2.165174 1.589354 ] [ 4.694039 1.985014 2.658467 ] [ 3.289805 2.94692 4.226906 ] [ 3.352089 4.483007 2.429606 ] [ 5.033516 4.030044 3.913159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.619068e-10 2.165174e-10 1.589354e-10 ] [ 4.694039000000001e-10 1.985014e-10 2.658467e-10 ] [ 3.289805e-10 2.94692e-10 4.226906e-10 ] [ 3.352089e-10 4.483007e-10 2.429606e-10 ] [ 5.033516e-10 4.030044e-10 3.913159e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8884118 -0.7217047 -2.6469421 ] [ 5.4275408 -6.7850475 -3.5589306 ] [ -9.4938727 -4.1945835 9.3236279 ] [ -3.7513605 6.1578973 -5.2477509 ] [ 9.7061042 5.5434383 2.1299957 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.025569236402845e-09 -1.156298397461478e-09 -4.240868749231256e-09 ] [ 8.695878978198128e-09 -1.087084447551749e-08 -5.702035402369717e-09 ] [ -1.521086088079137e-08 -6.720463617693438e-09 1.49380986424186e-08 ] [ -6.010342089292599e-09 9.866039087347443e-09 -8.407823803762158e-09 ] [ 1.555089322828869e-08 8.881567243107297e-09 3.41262931294453e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.13230678 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.119788296893291e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.4176575 1.0802019 1.0175923 ] [ 4.1019342 1.5045101 1.7002845 ] [ 3.7350591 3.0483055 4.7966708 ] [ 4.1839121 4.8776553 2.5684149 ] [ 4.5499541 5.0994862 4.7345295 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4176575e-10 1.0802019e-10 1.0175923e-10 ] [ 4.1019342e-10 1.5045101e-10 1.7002845e-10 ] [ 3.7350591e-10 3.0483055e-10 4.796670800000001e-10 ] [ 4.1839121e-10 4.8776553e-10 2.5684149e-10 ] [ 4.5499541e-10 5.0994862e-10 4.7345295e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.06e-05 1.78e-05 2.86e-05 ] [ -7.06e-05 -1.78e-05 -2.86e-05 ] [ 3.2e-06 3.75e-05 -9.27e-05 ] [ -2.93e-05 -8.34e-05 3.27e-05 ] [ 2.61e-05 4.59e-05 6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.1311366942848e-13 2.851874385024e-14 4.582225135488e-14 ] [ -1.1311366942848e-13 -2.851874385024e-14 -4.582225135488e-14 ] [ 5.126965186560001e-15 6.008162327999999e-14 -1.4852177274816e-13 ] [ -4.694377498944e-14 -1.3362153017472e-13 5.239117550016001e-14 ] [ 4.181680980288e-14 7.353990689472e-14 9.6130597248e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.135307 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.065814150723059e-18 } }