{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.669584 2.17361 1.86928 ] [ 2.40373 2.157546 4.053208 ] [ 2.652376 4.1548 1.079323 ] [ 1.859138 4.715654 3.12876 ] [ 4.632592 2.488435 2.820091 ] [ 5.239324 3.537857 1.028061 ] [ 3.752209 4.156911 4.495978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.669584e-10 2.17361e-10 1.86928e-10 ] [ 2.40373e-10 2.157546e-10 4.053208e-10 ] [ 2.652376e-10 4.1548e-10 1.079323e-10 ] [ 1.859138e-10 4.715654e-10 3.12876e-10 ] [ 4.632592e-10 2.488435e-10 2.820091e-10 ] [ 5.239324e-10 3.537857e-10 1.028061e-10 ] [ 3.752209000000001e-10 4.156911e-10 4.495978e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0890862 2.2142329 -0.7823074 ] [ -3.2911453 0.621979 2.4757652 ] [ 2.6105088 1.4163674 -2.7241729 ] [ 0.9209153 -5.89252 -0.683439 ] [ 4.29924 -0.7564661 2.0297616 ] [ -2.7173796 1.3647611 -1.3272047 ] [ 1.266947 1.0316458 1.0115972 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.949261689275914e-09 3.547592185386184e-09 -1.253394626558834e-09 ] [ -5.272996055315802e-09 9.96520212428563e-10 3.966613122030237e-09 ] [ 4.182496167752662e-09 2.269270734743282e-09 -4.364606131396936e-09 ] [ 1.475468963397018e-09 -9.440857781596417e-09 -1.094989987542931e-09 ] [ 6.888141815208193e-09 -1.211992299847755e-09 3.252036581317601e-09 ] [ -4.353722064958855e-09 2.186588327397291e-09 -2.126416341355878e-09 ] [ 2.029872863192698e-09 1.652878781706513e-09 1.620757383506742e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.51445 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.286777217857056e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3256098 2.1085529 1.8219356 ] [ 2.4202026 2.168802 4.2958132 ] [ 2.9702598 4.3789128 0.8897159 ] [ 1.8163468 4.3079901 3.0704644 ] [ 4.5791186 2.4421351 2.9115508 ] [ 5.1953883 3.7014649 1.0055787 ] [ 3.9020271 4.2769552 4.4796424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3256098e-10 2.1085529e-10 1.8219356e-10 ] [ 2.4202026e-10 2.168802e-10 4.295813200000001e-10 ] [ 2.9702598e-10 4.3789128e-10 8.897159e-11 ] [ 1.8163468e-10 4.3079901e-10 3.0704644e-10 ] [ 4.5791186e-10 2.4421351e-10 2.9115508e-10 ] [ 5.1953883e-10 3.7014649e-10 1.0055787e-10 ] [ 3.9020271e-10 4.2769552e-10 4.4796424e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.15e-05 0.0001126 5.82e-05 ] [ -3.88e-05 1.15e-05 -4.3e-06 ] [ -2.94e-05 -7.81e-05 -4.35e-05 ] [ -2.2e-06 -5.63e-05 -2.48e-05 ] [ 4.68e-05 -2.95e-05 -9.33e-05 ] [ 1.77e-05 2.47e-05 5.24e-05 ] [ 1.73e-05 1.51e-05 5.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.84250311392e-14 1.8040508750208e-13 9.324667933055999e-14 ] [ -6.216445288704e-14 1.84250311392e-14 -6.889359469440001e-15 ] [ -4.710399265152e-14 -1.2512999408448e-13 -6.969468300480001e-14 ] [ -3.52478856576e-15 -9.020254375104e-14 -3.973398019584e-14 ] [ 7.498186585344001e-14 -4.72642103136e-14 -1.4948307872064e-13 ] [ 2.835852618816e-14 3.957376253376001e-14 8.395405492992e-14 ] [ 2.771765553984e-14 2.419286697408e-14 8.844014946816001e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.03949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.851550885395539e-18 } }