{ "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" [ [ 2.488897 2.770028 3.014921 ] [ 0.2049674 2.791914 3.698619 ] [ 0.8141582 3.850123 1.870554 ] [ 0.3012674 5.24423 3.479153 ] [ 2.657762 5.04937 3.20133 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.488897e-10 2.770028e-10 3.014921e-10 ] [ 2.049674e-11 2.791914e-10 3.698619e-10 ] [ 8.141582e-11 3.850123e-10 1.870554e-10 ] [ 3.012674e-11 5.244230000000001e-10 3.479153e-10 ] [ 2.657762e-10 5.04937e-10 3.20133e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6663672 -2.1330566 0.7013037 ] [ -1.5116092 -1.6869039 2.9179925 ] [ 0.7095856 0.360567 -6.1390154 ] [ -1.1924517 2.2500555 2.7074845 ] [ 0.3281081 1.2093379 -0.1877654 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.669814591504004e-09 -3.417533443519484e-09 1.123612401477746e-09 ] [ -2.421864939979433e-09 -2.702718012383473e-09 4.675139401687244e-09 ] [ 1.13688146814287e-09 5.77692022391478e-10 -9.835787029646161e-09 ] [ -1.910518250913578e-09 3.604986347303187e-09 4.337868402817172e-09 ] [ 5.256871312461354e-10 1.937572925990628e-09 -3.008333365536636e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.782654 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.048006955930664e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5015629 2.6738133 3.1282146 ] [ 0.1584157 2.7986464 3.7442271 ] [ 0.927345 3.9159555 1.6656009 ] [ 0.2682908 5.2210412 3.6712745 ] [ 2.6114376 5.0962086 3.05526 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5015629e-10 2.6738133e-10 3.128214600000001e-10 ] [ 1.584157e-11 2.7986464e-10 3.7442271e-10 ] [ 9.27345e-11 3.9159555e-10 1.6656009e-10 ] [ 2.682908e-11 5.2210412e-10 3.6712745e-10 ] [ 2.6114376e-10 5.096208599999999e-10 3.05526e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-06 3.1e-06 -4.2e-06 ] [ 2e-06 -2e-07 -5.9e-06 ] [ 1.6e-06 6.1e-06 2.85e-05 ] [ 5e-06 -5.9e-06 -1.5e-05 ] [ -4.6e-06 -3e-06 -3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706535999999e-15 4.9667475654e-15 -6.729141862799999e-15 ] [ 3.204353268e-15 -3.204353268e-16 -9.452842140600001e-15 ] [ 2.5634826144e-15 9.773277467399999e-15 4.5662034069e-14 ] [ 8.010883169999999e-15 -9.452842140600001e-15 -2.403264951e-14 ] [ -7.370012516399999e-15 -4.806529901999999e-15 -5.607618218999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.867937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.221888462318406e-18 } }