{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7266937 0.3281129 0.1138198 ] [ 0.6755994 0.7068783 2.528749 ] [ 1.24494 2.902842 0.1722514 ] [ 2.894919 0.4231749 1.051303 ] [ 2.63173 1.048668 2.819948 ] [ 2.452649 2.84958 1.823943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.266937e-11 3.281129e-11 1.138198e-11 ] [ 6.755994e-11 7.068783e-11 2.528749e-10 ] [ 1.24494e-10 2.902842e-10 1.722514e-11 ] [ 2.894919e-10 4.231749e-11 1.051303e-10 ] [ 2.63173e-10 1.048668e-10 2.819948e-10 ] [ 2.452649e-10 2.84958e-10 1.823943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4144408 0.5739282 -1.0153322 ] [ -14.853124 -3.0487579 1.5671714 ] [ -9.5807756 -1.1421965 -12.4173084 ] [ 8.9070842 -12.6821234 -24.1094635 ] [ 6.9299049 3.3052503 25.0945373 ] [ 10.0113513 12.9938992 10.8803954 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.266183999936267e-09 9.195343516336787e-10 -1.626741526587815e-09 ] [ -2.379732821470461e-08 -4.884648670102908e-09 2.510885398553068e-09 ] [ -1.535009480191733e-08 -1.830000543736581e-09 -1.989472137565192e-08 ] [ 1.427072218231058e-08 -2.031900178098463e-08 -3.862761907797585e-08 ] [ 1.110293170662211e-08 5.29559480018149e-09 4.020588130310144e-08 ] [ 1.603995312762552e-08 2.081852168279129e-08 1.743231527856108e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.9562662 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.33863726352397e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.817938 0.5134763 0.2536613 ] [ 0.2403329 0.4493301 2.7088641 ] [ 1.1100133 2.9633771 -0.0448787 ] [ 3.2076673 -0.1465184 0.7220083 ] [ 2.6794827 1.0752724 2.8653704 ] [ 2.5710967 3.4043186 2.0049888 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.17938e-11 5.134763e-11 2.536613e-11 ] [ 2.403329e-11 4.493301000000001e-11 2.7088641e-10 ] [ 1.1100133e-10 2.9633771e-10 -4.48787e-12 ] [ 3.2076673e-10 -1.465184e-11 7.220083000000001e-11 ] [ 2.6794827e-10 1.0752724e-10 2.8653704e-10 ] [ 2.5710967e-10 3.4043186e-10 2.0049888e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.5e-06 -9.2e-06 5.2e-06 ] [ -1.87e-05 4e-07 -2.3e-06 ] [ -7.2e-06 1.97e-05 -8e-07 ] [ 2.02e-05 -3e-05 -2e-06 ] [ 1.31e-05 1.72e-05 -1.28e-05 ] [ -2.9e-06 2e-06 1.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.209794853e-15 -1.47400250328e-14 8.331318496799998e-15 ] [ -2.99607030558e-14 6.408706536e-16 -3.685006258199999e-15 ] [ -1.15356717648e-14 3.15628796898e-14 -1.2817413072e-15 ] [ 3.236396800679999e-14 -4.806529901999999e-14 -3.204353268e-15 ] [ 2.09885139054e-14 2.75574381048e-14 -2.05078609152e-14 ] [ -4.6463122386e-15 3.204353268e-15 2.05078609152e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.273917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767586619505538e-18 } }