{ "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" [ [ 2.690681 1.842727 3.696963 ] [ 2.658202 3.646198 2.018485 ] [ 5.329976 0.2810446 1.792372 ] [ 5.111587 2.700534 2.069297 ] [ 3.393505 1.493232 0.8693091 ] [ 5.014849 1.504764 3.993476 ] [ 3.843884 3.656776 4.040771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.690681e-10 1.842727e-10 3.696963e-10 ] [ 2.658202e-10 3.646198e-10 2.018485e-10 ] [ 5.329976000000001e-10 2.810446e-11 1.792372e-10 ] [ 5.111587e-10 2.700534e-10 2.069297e-10 ] [ 3.393505e-10 1.493232e-10 8.693091e-11 ] [ 5.014849e-10 1.504764e-10 3.993476e-10 ] [ 3.843884e-10 3.656776e-10 4.040771000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9728298 -3.1368088 -0.0775501 ] [ -0.051997 -0.9836576 -1.3650696 ] [ -0.5924132 0.377384 0.5965273 ] [ 0.6276925 2.5168713 -2.0122054 ] [ -0.3455973 0.0394467 -0.4297781 ] [ 0.8130977 -2.3283867 1.7440164 ] [ 2.522047 3.5151512 1.5440594 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.762998442418893e-09 -5.025721764685578e-09 -1.242489581843634e-10 ] [ -8.330837843809799e-11 -1.575993222576518e-09 -2.187082616903726e-09 ] [ -9.491505867131686e-10 6.046358268454559e-10 9.557421016031082e-10 ] [ 1.005674256837045e-09 4.032472387645204e-09 -3.223908474688623e-09 ] [ -5.537079188334882e-10 6.320058102840779e-11 -6.885804296249153e-10 ] [ 1.302726136099142e-09 -3.730486765656367e-09 2.794222325392797e-09 ] [ 4.040764773249798e-09 5.63189311761706e-09 2.473855892188059e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.819522 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.175437504544894e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.491785 1.862873 4.0863962 ] [ 2.6033054 3.1999598 2.0442985 ] [ 5.1581403 0.4157381 1.8715736 ] [ 5.2053054 2.8926221 1.9422432 ] [ 3.6142785 1.6456543 0.5084124 ] [ 4.8870301 1.380647 4.0607129 ] [ 4.0828394 3.7277812 3.9670363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.491785e-10 1.862873e-10 4.086396200000001e-10 ] [ 2.6033054e-10 3.1999598e-10 2.0442985e-10 ] [ 5.158140300000001e-10 4.157381e-11 1.8715736e-10 ] [ 5.205305400000001e-10 2.8926221e-10 1.9422432e-10 ] [ 3.614278500000001e-10 1.6456543e-10 5.084124e-11 ] [ 4.887030099999999e-10 1.380647e-10 4.0607129e-10 ] [ 4.0828394e-10 3.7277812e-10 3.9670363e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.5e-06 -2.64e-05 -1.87e-05 ] [ -4.1e-06 2.27e-05 9.8e-06 ] [ 9.1e-06 -2.2e-05 4.9e-06 ] [ 1.5e-05 6.5e-06 3.3e-06 ] [ -2.03e-05 -9.2e-06 -5.9e-06 ] [ -6e-07 1.67e-05 1.3e-06 ] [ 4.3e-06 1.18e-05 5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.607618218999999e-15 -4.22974631376e-14 -2.99607030558e-14 ] [ -6.568924199399999e-15 3.636940959179999e-14 1.57013310132e-14 ] [ 1.45798073694e-14 -3.5247885948e-14 7.850665506599998e-15 ] [ 2.403264951e-14 1.0414148121e-14 5.2871828922e-15 ] [ -3.252418567019999e-14 -1.47400250328e-14 -9.452842140600001e-15 ] [ -9.613059803999998e-16 2.67563497878e-14 2.0828296242e-15 ] [ 6.8893595262e-15 1.89056842812e-14 8.331318496799998e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.454609 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.437407323140611e-18 } }