{ "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" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1946327 -0.0774919 0.0981718 ] [ -2.0107614 2.2902261 -0.0881784 ] [ -0.0721917 -0.3962662 -0.0881553 ] [ 1.1231833 -1.7783638 -0.6173531 ] [ 1.1544025 -0.0381043 0.6955151 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.118359641523317e-10 -1.241557115042646e-10 1.572885640777212e-10 ] [ -3.221594931629127e-09 3.669346743996947e-09 -1.412773721035056e-10 ] [ -1.156638549087378e-10 -6.348884464839708e-10 -1.412403618232602e-10 ] [ 1.799538038959012e-09 -2.849252927111449e-09 -9.891087117474653e-10 ] [ 1.849556711731185e-09 -6.10498191149262e-11 1.114338041814173e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.609191 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.180432782784309e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1201493 1.9662202 1.9516068 ] [ 2.8661178 4.1521528 1.1502022 ] [ 2.8144926 3.5816223 3.5269379 ] [ 4.208949 2.1293451 0.8636723 ] [ 4.9032872 3.7447576 2.4389963 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1201493e-10 1.9662202e-10 1.9516068e-10 ] [ 2.8661178e-10 4.1521528e-10 1.1502022e-10 ] [ 2.8144926e-10 3.5816223e-10 3.5269379e-10 ] [ 4.208949e-10 2.1293451e-10 8.636723e-11 ] [ 4.903287200000001e-10 3.7447576e-10 2.4389963e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-05 -6.1e-06 6.1e-06 ] [ -9e-07 2.9e-06 -3.7e-06 ] [ -1.25e-05 8e-07 7.2e-06 ] [ 9.7e-06 5.5e-06 -3e-06 ] [ 1.46e-05 -3.2e-06 -6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.7623942974e-14 -9.773277467399999e-15 9.773277467399999e-15 ] [ -1.4419589706e-15 4.6463122386e-15 -5.9280535458e-15 ] [ -2.0027207925e-14 1.2817413072e-15 1.15356717648e-14 ] [ 1.55411133498e-14 8.811971486999999e-15 -4.806529901999999e-15 ] [ 2.33917788564e-14 -5.1269652288e-15 -1.07345834478e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971627206706e-18 } }