{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4538168 1.6923722 0.2196315 ] [ -0.7569846 -2.7925455 -0.7095804 ] [ -2.9083934 -1.5796906 0.3494904 ] [ 1.8847095 2.5458193 0.5664199 ] [ -1.5180509 0.5622446 -0.9496624 ] [ 1.6769306 1.2254544 0.3052862 ] [ 1.167972 -1.6536544 0.2184148 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.270946730766512e-10 2.711479194871175e-09 3.518884573903709e-10 ] [ -1.212823038417836e-09 -4.474151149481846e-09 -1.136873136824374e-09 ] [ -4.659759947959815e-09 -2.53094336826944e-09 5.599453526873135e-10 ] [ 3.019637522777822e-09 4.078852196846235e-09 9.075047288126165e-10 ] [ -2.43218568120267e-09 9.008151607126762e-10 -1.521526907468362e-09 ] [ 2.6867390241596e-09 1.963394405712489e-09 4.891224163226508e-10 ] [ 1.871297447566248e-09 -2.649446440391289e-09 3.499390890797831e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.920758005765546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.711004310640599e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3558921 1.8815923 1.1779736 ] [ 2.2350965 1.9005226 3.5596045 ] [ 1.4588968 3.8025117 2.3111489 ] [ 3.1598257 4.9291705 3.5824327 ] [ 4.2866775 2.9293438 3.6070618 ] [ 3.28062 4.9102425 1.2008033 ] [ 4.4025824 2.9111812 1.3218807 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3558921e-10 1.8815923e-10 1.1779736e-10 ] [ 2.2350965e-10 1.9005226e-10 3.5596045e-10 ] [ 1.4588968e-10 3.8025117e-10 2.3111489e-10 ] [ 3.1598257e-10 4.9291705e-10 3.5824327e-10 ] [ 4.2866775e-10 2.9293438e-10 3.6070618e-10 ] [ 3.28062e-10 4.9102425e-10 1.2008033e-10 ] [ 4.4025824e-10 2.9111812e-10 1.3218807e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.87e-05 -5.2e-06 -1.1e-06 ] [ 1.37e-05 1.07e-05 -3.34e-05 ] [ -1.04e-05 -1.16e-05 1.89e-05 ] [ 1.1e-05 -9.2e-06 -1.71e-05 ] [ 2.3e-06 -1.6e-06 3.62e-05 ] [ -1.3e-06 1.56e-05 -1.55e-05 ] [ 3.4e-06 1.2e-06 1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.99607030558e-14 -8.331318496799998e-15 -1.7623942974e-15 ] [ 2.19498198858e-14 1.71432899838e-14 -5.351269957559999e-14 ] [ -1.66626369936e-14 -1.85852489544e-14 3.02811383826e-14 ] [ 1.7623942974e-14 -1.47400250328e-14 -2.73972204414e-14 ] [ 3.685006258199999e-15 -2.5634826144e-15 5.799879415079998e-14 ] [ -2.0828296242e-15 2.49939554904e-14 -2.4833737827e-14 ] [ 5.4474005556e-15 1.9226119608e-15 1.9226119608e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.808943005765546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333960226207528e-18 } }