{ "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" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.1073804 -9.1802572 -10.3565536 ] [ -12.3701941 -7.0351516 9.2768928 ] [ -3.5414127 12.3160586 10.6091519 ] [ 14.490905 -9.9126724 -1.4021591 ] [ 8.5280821 13.8120226 -8.127332 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.138727871201215e-08 -1.470839345877087e-08 -1.659302804998207e-08 ] [ -1.98192357817781e-08 -1.127155541730371e-08 1.486322075782785e-08 ] [ -5.673968632544204e-09 1.973250114932278e-08 1.69977351406959e-08 ] [ 2.321698920523383e-08 -1.588185196892943e-08 -2.24650652866197e-09 ] [ 1.366349376088297e-08 2.212929969568123e-08 -1.30214213198797e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.3463151 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.157034577450014e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4891619 -0.2419209 0.8943359 ] [ 0.0308657 0.9051865 2.9297625 ] [ 1.2598393 2.9280537 3.2323865 ] [ 2.3791361 1.0839002 1.6063318 ] [ 2.7425863 3.4671705 1.4492248 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.891619e-11 -2.419209e-11 8.943359e-11 ] [ 3.08657e-12 9.051865e-11 2.9297625e-10 ] [ 1.2598393e-10 2.9280537e-10 3.2323865e-10 ] [ 2.3791361e-10 1.0839002e-10 1.6063318e-10 ] [ 2.7425863e-10 3.4671705e-10 1.4492248e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.3e-06 -1.06e-05 -8e-06 ] [ -1.49e-05 -2.1e-06 9.1e-06 ] [ -2.4e-06 9.6e-06 1.01e-05 ] [ 2.43e-05 1.93e-05 -9.3e-06 ] [ 2e-07 -1.62e-05 -2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.169588933184e-14 -1.698307218048e-14 -1.28174129664e-14 ] [ -2.387243164992e-14 -3.36457090368e-15 1.457980724928e-14 ] [ -3.84522388992e-15 1.538089555968e-14 1.618198387008e-14 ] [ 3.893289188544e-14 3.092200878144e-14 -1.490024257344e-14 ] [ 3.2043532416e-16 -2.595526125696e-14 -3.2043532416e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.036401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.409097014317374e-18 } }