{ "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" [ [ 0.4008083 0.5190667 2.588988 ] [ 0.3705603 2.591564 0.7446841 ] [ 2.694344 0.0700188 2.876141 ] [ 2.159519 1.331763 1.766469 ] [ 2.561241 2.816208 0.1583109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.008083e-11 5.190667e-11 2.588988e-10 ] [ 3.705603e-11 2.591564e-10 7.446841e-11 ] [ 2.694344e-10 7.001880000000001e-12 2.876141e-10 ] [ 2.159519e-10 1.331763e-10 1.766469e-10 ] [ 2.561241e-10 2.816208e-10 1.583109e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5214386 -0.0992109 0.1558588 ] [ -1.1271653 -0.5476135 0.6242651 ] [ 2.7040611 -5.753799 4.9244697 ] [ 0.1529373 5.6151168 -4.615654 ] [ 0.7916054 0.7855067 -1.0889396 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.039790008985672e-09 -1.589533858181106e-10 2.497133275632792e-10 ] [ -1.8059179063156e-09 -8.773735541629589e-10 1.000182956641673e-09 ] [ 4.332383511328337e-09 -9.218602314532564e-09 7.88987028818099e-09 ] [ 2.450325685270482e-10 8.99640893414085e-09 -7.395092989428636e-09 ] [ 1.268291675228223e-09 1.258520480590448e-09 -1.744673582957306e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.218137332689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.156473097543848e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2472328 0.5107927 2.2054513 ] [ 0.6649685 2.6540362 1.2521209 ] [ 2.60962 0.27741 2.0017195 ] [ 2.5129123 2.5368976 2.7515282 ] [ 2.1517389 1.349484 -0.0762269 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.472328e-11 5.107927e-11 2.2054513e-10 ] [ 6.649685e-11 2.6540362e-10 1.2521209e-10 ] [ 2.60962e-10 2.7741e-11 2.0017195e-10 ] [ 2.5129123e-10 2.5368976e-10 2.7515282e-10 ] [ 2.1517389e-10 1.349484e-10 -7.62269e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.9e-06 -1.94e-05 1.01e-05 ] [ -7.6e-06 2.15e-05 -1.95e-05 ] [ 3e-07 7e-06 -1.32e-05 ] [ 1.13e-05 -2e-07 1.49e-05 ] [ 1.8e-06 -8.8e-06 7.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.452842140600001e-15 -3.10822266996e-14 1.61819840034e-14 ] [ -1.21765424184e-14 3.4446797631e-14 -3.1242444363e-14 ] [ 4.806529901999999e-16 1.1215236438e-14 -2.11487315688e-14 ] [ 1.81045959642e-14 -3.204353268e-16 2.38724318466e-14 ] [ 2.8839179412e-15 -1.40991543792e-14 1.24969777452e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }