{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -52.0140957 -35.143587 -4.1174354 ] [ -3.0587227 0.8930321 3.3637373 ] [ 106.1434359 -109.0226103 -76.3146921 ] [ 74.6841067 -9.2118449 139.4340657 ] [ -125.7547242 152.4850101 -62.3656755 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.333576876917986e-08 -5.630623392634615e-08 -6.596858789884442e-09 ] [ -4.900614039825391e-09 1.430795164031951e-09 5.389301304974248e-09 ] [ 1.700605328514568e-07 -1.746734788003477e-07 -1.222696165135244e-07 ] [ 1.196571306859028e-07 -1.475900265481206e-08 2.233980020481608e-07 ] [ -2.014812807283543e-07 2.44307920217474e-07 -9.992082804972627e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 71.441567 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.144620093437455e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.4562372 -0.0183669 1.2798981 ] [ 0.1401622 2.4082781 2.3742075 ] [ 2.8966238 0.0648829 0.1737368 ] [ 2.6170801 1.3894095 2.4875162 ] [ 1.4818854 2.3387238 0.0545056 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.562372e-11 -1.83669e-12 1.2798981e-10 ] [ 1.401622e-11 2.4082781e-10 2.3742075e-10 ] [ 2.8966238e-10 6.488289999999999e-12 1.737368e-11 ] [ 2.6170801e-10 1.3894095e-10 2.4875162e-10 ] [ 1.4818854e-10 2.3387238e-10 5.450560000000001e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.83e-05 6.69e-05 4.8e-06 ] [ -3.5e-06 2.73e-05 5e-07 ] [ 3.53e-05 7.7e-06 5.8e-06 ] [ -7.47e-05 -2.58e-05 -0.0001137 ] [ -5.5e-06 -7.62e-05 0.0001026 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.73851314222e-14 1.071856168146e-13 7.690447843199998e-15 ] [ -5.607618218999999e-15 4.37394221082e-14 8.010883169999999e-16 ] [ 5.655683518019999e-14 1.23367600818e-14 9.2926244772e-15 ] [ -1.196825945598e-13 -4.133615715719999e-14 -1.821674832858e-13 ] [ -8.811971486999999e-15 -1.220858595108e-13 1.643833226484e-13 ] ] } "relaxed-potential-energy" { "source-value" -15.907624 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.548682347525762e-18 } }