{ "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" [ [ 0.148581 1.499098 2.912634 ] [ 0.4436014 1.560152 0.6683764 ] [ 2.110053 0.4783189 0.3653162 ] [ 2.063967 1.021193 2.434749 ] [ 2.249538 2.67297 1.348927 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.48581e-11 1.499098e-10 2.912634e-10 ] [ 4.436014e-11 1.560152e-10 6.683764e-11 ] [ 2.110053e-10 4.783189e-11 3.653162e-11 ] [ 2.063967e-10 1.021193e-10 2.434749e-10 ] [ 2.249538e-10 2.67297e-10 1.348927e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.601828 -2.4627589 1.5141952 ] [ -12.5773925 2.9444595 -20.2813873 ] [ -6.1862897 -15.3323215 -1.9718668 ] [ 15.0026615 -0.4866268 9.9419117 ] [ 3.1591927 15.3372477 10.7971472 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.64234759286952e-10 -3.945774764755542e-09 2.426008168754957e-09 ] [ -2.015120438014684e-08 4.717544210659321e-09 -3.249436483716434e-08 ] [ -9.911528808494869e-09 -2.456508725227583e-08 -3.159278912320351e-09 ] [ 2.403691370311139e-08 -7.796620884381912e-10 1.592869862303122e-08 ] [ 5.061584726243371e-09 2.457297989481024e-08 1.729893695769852e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.44668169 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.156629665536315e-20 } "relaxed-configuration-positions" { "source-value" [ [ -0.0972453 1.2066083 2.9280617 ] [ 0.3396469 1.8949957 0.4692654 ] [ 1.9547787 -0.1265148 0.3457727 ] [ 2.4666501 0.9976935 2.6227333 ] [ 2.3519101 3.2589493 1.3641695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.72453e-12 1.2066083e-10 2.9280617e-10 ] [ 3.396469e-11 1.8949957e-10 4.692654e-11 ] [ 1.9547787e-10 -1.265148e-11 3.457727e-11 ] [ 2.4666501e-10 9.976935000000001e-11 2.6227333e-10 ] [ 2.3519101e-10 3.2589493e-10 1.3641695e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3e-06 -4.4e-06 -1.3e-06 ] [ 3.9e-06 1.5e-06 6.9e-06 ] [ -1e-06 -6.9e-06 -1.9e-06 ] [ -4.6e-06 5.3e-06 -2.5e-06 ] [ 3e-06 4.5e-06 -1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.0828296242e-15 -7.0495771896e-15 -2.0828296242e-15 ] [ 6.248488872599999e-15 2.403264951e-15 1.10550187746e-14 ] [ -1.602176634e-15 -1.10550187746e-14 -3.0441356046e-15 ] [ -7.370012516399999e-15 8.4915361602e-15 -4.005441585e-15 ] [ 4.806529901999999e-15 7.209794853e-15 -1.9226119608e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.025254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.926658097671503e-18 } }