{ "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" [ [ 2.229662 1.543061 1.287817 ] [ 2.031016 3.038651 3.160637 ] [ 0.5900505 3.664885 1.130231 ] [ 2.845897 4.610953 2.071813 ] [ 3.999567 2.736591 1.793936 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.229662e-10 1.543061e-10 1.287817e-10 ] [ 2.031016e-10 3.038651e-10 3.160637e-10 ] [ 5.900505000000001e-11 3.664885e-10 1.130231e-10 ] [ 2.845897e-10 4.610953e-10 2.071813e-10 ] [ 3.999567e-10 2.736591e-10 1.793936e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9960105 -3.2097698 -1.5017116 ] [ -4.5317004 -4.2868023 5.2048318 ] [ 0.0 0.0 0.0 ] [ 1.1301291 8.4898823 -2.795414 ] [ 6.3975819 -0.9933102 -0.9077062 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.800138018318657e-09 -5.142618174078853e-09 -2.406007236526754e-09 ] [ -7.260584493168453e-09 -6.868214479637457e-09 8.33905989386016e-09 ] [ 0.0 0.0 0.0 ] [ 1.810666437423449e-09 1.360229104647018e-08 -4.478746993156475e-09 ] [ 1.025005623428132e-08 -1.591458392753867e-09 -1.454305664176931e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.062094 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.110368725911596e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7174758 1.3248639 1.6509085 ] [ 1.4418488 3.2303471 2.2889001 ] [ -0.5955797 3.8645468 1.4436101 ] [ 3.4284092 4.539932 2.3495026 ] [ 4.7040384 2.6344513 1.7115127 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7174758e-10 1.3248639e-10 1.6509085e-10 ] [ 1.4418488e-10 3.2303471e-10 2.2889001e-10 ] [ -5.955797e-11 3.8645468e-10 1.4436101e-10 ] [ 3.4284092e-10 4.539932e-10 2.3495026e-10 ] [ 4.7040384e-10 2.6344513e-10 1.7115127e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.5e-06 -1.6e-06 -2.6e-06 ] [ -1e-07 -2.41e-05 1.13e-05 ] [ -1.35e-05 5.1e-06 -9.6e-06 ] [ 2.22e-05 2.41e-05 1e-06 ] [ -1e-05 -3.6e-06 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.403264951e-15 -2.5634826144e-15 -4.165659248399999e-15 ] [ -1.602176634e-16 -3.86124568794e-14 1.81045959642e-14 ] [ -2.162938455899999e-14 8.1711008334e-15 -1.53808956864e-14 ] [ 3.55683212748e-14 3.86124568794e-14 1.602176634e-15 ] [ -1.602176634e-14 -5.767835882399999e-15 -3.204353268e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.303473 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.811016032364988e-18 } }