{ "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" [ [ 1.040169 0.3467498 1.049872 ] [ 0.0600036 1.405044 1.572488 ] [ 2.420904 2.65585 0.1683769 ] [ 1.553585 1.595169 0.3590691 ] [ 2.059971 2.654503 2.612695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.040169e-10 3.467498e-11 1.049872e-10 ] [ 6.00036e-12 1.405044e-10 1.572488e-10 ] [ 2.420904e-10 2.65585e-10 1.683769e-11 ] [ 1.553585e-10 1.595169e-10 3.590691e-11 ] [ 2.059971e-10 2.654503e-10 2.612695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0815702 -109.5322355 13.4603689 ] [ -45.1995653 34.0728103 28.3790563 ] [ 66.8142556 85.8337245 -21.0751481 ] [ -21.8870391 -15.2250973 -25.2928097 ] [ 1.353919 4.850798 4.5285325 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.73286648819398e-09 -1.754899869420598e-07 2.156588835892342e-08 ] [ -7.241768679398295e-08 5.459066006761344e-08 4.546826052422695e-08 ] [ 1.070482382584755e-07 1.375207866700882e-07 -3.376610956571754e-08 ] [ -3.506690234455547e-08 -2.43932949434652e-08 -4.052354837568346e-08 ] [ 2.169217368256915e-09 7.7718351478234e-09 7.255508898032976e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 49.569294 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.941876395636171e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7542209 -0.6543842 0.982891 ] [ 0.2834493 1.5424981 2.061476 ] [ 2.8575382 3.1197447 0.4338898 ] [ 1.3755233 1.4011674 -0.2820082 ] [ 1.8639009 3.2482898 2.5662524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.542209e-11 -6.543842e-11 9.82891e-11 ] [ 2.834493e-11 1.5424981e-10 2.061476e-10 ] [ 2.8575382e-10 3.1197447e-10 4.338898e-11 ] [ 1.3755233e-10 1.4011674e-10 -2.820082e-11 ] [ 1.8639009e-10 3.2482898e-10 2.5662524e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.5e-06 -1.81e-05 -9.6e-06 ] [ -8.2e-06 -1.5e-05 4.07e-05 ] [ -3.4e-06 -4.25e-05 -1.23e-05 ] [ 2.77e-05 4.99e-05 -8.3e-06 ] [ -1.26e-05 2.57e-05 -1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.6076181728e-15 -2.899939683648e-14 -1.538089555968e-14 ] [ -1.313784829056e-14 -2.4032649312e-14 6.520858846656e-14 ] [ -5.44740051072e-15 -6.8092506384e-14 -1.970677243584e-14 ] [ 4.438029239616e-14 7.994861337792e-14 -1.329806595264e-14 ] [ -2.018742542208e-14 4.117593915456e-14 -1.68228545184e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.164352 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.788726376078172e-18 } }