{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2677521 -4.4575975 -5.9613428 ] [ 2.1928675 6.1978391 0.3053823 ] [ -6.4339928 -0.7147558 -0.2527787 ] [ 0.5983586 -3.3234165 -1.7350527 ] [ 4.6736172 -3.1146758 3.5861329 ] [ -2.8893547 4.688693 1.1287116 ] [ 3.1262563 0.7239134 2.9289474 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.031162792324431e-09 -7.141858558276815e-09 -9.551124141424134e-09 ] [ 3.513361069957995e-09 9.93003298731159e-09 4.892763854971782e-10 ] [ -1.030839292748424e-08 -1.145165041775977e-09 -4.049961267128958e-10 ] [ 9.586761676729523e-10 -5.32470026135006e-09 -2.779860894698612e-09 ] [ 7.487960274100505e-09 -4.990260789245257e-09 5.745618338798658e-09 ] [ -4.62925658767808e-09 7.512114368599362e-09 1.808395352044754e-09 ] [ 5.008814795755293e-09 1.159837134519496e-09 4.692691086495052e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.272716 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.806088217691794e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5198004 1.5026771 2.600796 ] [ 2.374679 4.5796922 4.2001249 ] [ 0.8959168 3.3890456 2.5904318 ] [ 4.0907294 2.304669 0.8445248 ] [ 3.8524139 2.6145827 4.348729 ] [ 3.931882 5.6723989 2.5949376 ] [ 5.2936936 3.5889246 2.604939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5198004e-10 1.5026771e-10 2.600796e-10 ] [ 2.374679e-10 4.579692200000001e-10 4.2001249e-10 ] [ 8.959168e-11 3.3890456e-10 2.5904318e-10 ] [ 4.0907294e-10 2.304669e-10 8.445248e-11 ] [ 3.8524139e-10 2.6145827e-10 4.348729e-10 ] [ 3.931882e-10 5.6723989e-10 2.594937600000001e-10 ] [ 5.2936936e-10 3.5889246e-10 2.604939e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-06 2.7e-06 1.04e-05 ] [ -1.03e-05 1.79e-05 -6.1e-06 ] [ -8e-07 -9.8e-06 -2.2e-06 ] [ -6.2e-06 -1.1e-05 6.3e-06 ] [ -1.25e-05 5e-06 -2.01e-05 ] [ -1.8e-06 -1e-07 3.48e-05 ] [ 2.36e-05 -4.7e-06 -2.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.2817413072e-14 4.3258769118e-15 1.66626369936e-14 ] [ -1.65024193302e-14 2.86789617486e-14 -9.773277467399999e-15 ] [ -1.2817413072e-15 -1.57013310132e-14 -3.5247885948e-15 ] [ -9.9334951308e-15 -1.7623942974e-14 1.00937127942e-14 ] [ -2.0027207925e-14 8.010883169999999e-15 -3.22037503434e-14 ] [ -2.8839179412e-15 -1.602176634e-16 5.575574686319999e-14 ] [ 3.78113685624e-14 -7.530230179799999e-15 -3.6850062582e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.049323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.052038020411878e-18 } }