{ "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" [ [ 1.875325 2.956791 1.293332 ] [ 2.112421 5.47429 1.464888 ] [ 2.056962 4.106673 3.914817 ] [ 3.228113 2.011758 3.122182 ] [ 3.602336 4.040974 2.324239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.875325e-10 2.956791e-10 1.293332e-10 ] [ 2.112421e-10 5.47429e-10 1.464888e-10 ] [ 2.056962e-10 4.106673e-10 3.914817000000001e-10 ] [ 3.228113e-10 2.011758e-10 3.122182e-10 ] [ 3.602336e-10 4.040974e-10 2.324239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4301685 -3.0457596 -5.3691038 ] [ -2.5306232 2.37196 -0.6865326 ] [ -3.1156759 2.3093645 5.681265 ] [ -0.0912807 -5.1174557 2.2269641 ] [ 9.1677483 3.4818908 -1.8525928 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.495735821382829e-09 -4.879844863901185e-09 -8.602252653880609e-09 ] [ -4.054505360498308e-09 3.80029888878264e-09 -1.099946490199268e-09 ] [ -4.991863126096919e-09 3.700009841289093e-09 9.10239003456201e-09 ] [ -1.462478046751638e-10 -8.199067948070114e-09 3.567989845776839e-09 ] [ 1.468835211265322e-08 5.578604081899566e-09 -2.968180896476635e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.960349 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.115170853228527e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1524437 2.8614579 0.8545949 ] [ 1.6781518 5.1822912 1.770539 ] [ 2.2573713 4.3778258 4.1088126 ] [ 2.7316641 2.0569919 3.1928672 ] [ 4.0555261 4.1119192 2.1926443 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1524437e-10 2.8614579e-10 8.545949000000001e-11 ] [ 1.6781518e-10 5.1822912e-10 1.770539e-10 ] [ 2.2573713e-10 4.3778258e-10 4.108812600000001e-10 ] [ 2.7316641e-10 2.0569919e-10 3.1928672e-10 ] [ 4.0555261e-10 4.1119192e-10 2.1926443e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.42e-05 -2.06e-05 -2.36e-05 ] [ -7e-06 1.18e-05 3e-06 ] [ -6e-06 6.6e-06 1.24e-05 ] [ 7e-07 -6.1e-06 3.4e-06 ] [ 2.66e-05 8.3e-06 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.27509082028e-14 -3.300483866039999e-14 -3.78113685624e-14 ] [ -1.1215236438e-14 1.89056842812e-14 4.806529901999999e-15 ] [ -9.613059803999999e-15 1.05743657844e-14 1.98669902616e-14 ] [ 1.1215236438e-15 -9.773277467399999e-15 5.4474005556e-15 ] [ 4.26178984644e-14 1.32980660622e-14 7.690447843199998e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.338031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.656335170976765e-18 } }