{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0140975 0.5833675 2.011711 ] [ 0.3860738 2.863563 1.325373 ] [ 1.128451 1.622429 0.5509609 ] [ 2.086312 0.6042059 2.517228 ] [ 2.318087 2.883056 0.8671461 ] [ 2.902063 1.818717 2.74846 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.40975e-12 5.833675e-11 2.011711e-10 ] [ 3.860738e-11 2.863563e-10 1.325373e-10 ] [ 1.128451e-10 1.622429e-10 5.509609e-11 ] [ 2.086312e-10 6.042059e-11 2.517228e-10 ] [ 2.318087e-10 2.883056e-10 8.671461e-11 ] [ 2.902063e-10 1.818717e-10 2.74846e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.2111629 -9.7125472 6.0206125 ] [ -31.2100007 33.124938 9.893063 ] [ -3.7504481 -30.1833516 -35.7756698 ] [ -13.5676761 -53.9299249 6.6744123 ] [ 24.8504801 23.3310183 -6.4773246 ] [ 37.8888078 37.3698675 19.6649065 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.276879295276033e-08 -1.55612160522565e-08 9.646084590396241e-09 ] [ -5.000393345669163e-08 5.307200122904952e-08 1.585043424670151e-08 ] [ -6.008880263343781e-09 -4.835906027090628e-08 -5.731894174702062e-08 ] [ -2.173781344600692e-08 -8.640526483627979e-08 1.069358734463996e-08 ] [ 3.981485823187564e-08 3.738041205971696e-08 -1.037781803945271e-08 ] [ 6.070456204714469e-08 5.987312803089374e-08 3.150665344451796e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 26.613786 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.263998572017435e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.2762987 0.9203247 1.9138097 ] [ -0.0193044 3.2911909 1.8291564 ] [ 1.6095647 0.8828214 0.0768076 ] [ 2.0410041 0.0946847 2.5517031 ] [ 2.1660638 3.0827751 0.9026144 ] [ 3.3140549 2.1035416 2.7467878 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.762987e-11 9.203247000000001e-11 1.9138097e-10 ] [ -1.93044e-12 3.2911909e-10 1.8291564e-10 ] [ 1.6095647e-10 8.828214e-11 7.68076e-12 ] [ 2.0410041e-10 9.46847e-12 2.5517031e-10 ] [ 2.1660638e-10 3.0827751e-10 9.026144000000001e-11 ] [ 3.3140549e-10 2.1035416e-10 2.7467878e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.3e-06 7.3e-06 -1.16e-05 ] [ 8e-07 9.4e-06 2.52e-05 ] [ 7.2e-06 -2.73e-05 -2.3e-05 ] [ 2.3e-06 2.89e-05 -1.1e-06 ] [ -8e-06 -1.62e-05 8.7e-06 ] [ -9.6e-06 -2e-06 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.169588933184e-14 1.169588933184e-14 -1.858524880128e-14 ] [ 1.28174129664e-15 1.506046023552e-14 4.037485084416e-14 ] [ 1.153567166976e-14 -4.373942174784e-14 -3.68500622784e-14 ] [ 3.68500622784e-15 4.630290434112001e-14 -1.76239428288e-15 ] [ -1.28174129664e-14 -2.595526125696e-14 1.393893660096e-14 ] [ -1.538089555968e-14 -3.2043532416e-15 2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.124626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.423232217554382e-18 } }