{ "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" [ [ 1.367579 2.331666 2.560265 ] [ 1.247063 4.506514 1.455264 ] [ 1.553057 4.10894 4.144146 ] [ 3.394871 3.002275 1.909157 ] [ 3.306653 2.229629 4.162494 ] [ 4.84835 4.310072 3.519856 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.367579e-10 2.331666e-10 2.560265e-10 ] [ 1.247063e-10 4.506514e-10 1.455264e-10 ] [ 1.553057e-10 4.10894e-10 4.144146e-10 ] [ 3.394871e-10 3.002275e-10 1.909157e-10 ] [ 3.306653e-10 2.229629e-10 4.162494e-10 ] [ 4.84835e-10 4.310072e-10 3.519856e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5339799 -0.7018289 0.1353568 ] [ 0.2945094 -0.0457841 0.3044437 ] [ -0.1923354 0.3751735 0.6564016 ] [ 2.0208173 0.5597739 -1.7995717 ] [ 0.3343007 0.4960765 0.7662235 ] [ -0.9233121 -0.6834109 -0.0628539 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.457706732557122e-09 -1.124453855381781e-09 2.168655004263014e-10 ] [ 4.718560752858355e-10 -7.335421462436929e-11 4.877725784898489e-10 ] [ -3.081552812322163e-10 6.010942104437088e-10 1.051671297375713e-09 ] [ 3.23770623296818e-09 8.968566555140372e-10 -2.883231705193311e-09 ] [ 5.356087658570746e-10 7.948021704282912e-10 1.227625378007549e-09 ] [ -1.479309060321752e-09 -1.094944966379887e-09 -1.007030491061011e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.728047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.039257933184358e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9787451 1.9966336 2.401271 ] [ 1.1974069 4.2447485 1.9658518 ] [ 1.490932 4.5847883 4.3062586 ] [ 3.5491591 3.4531587 1.275916 ] [ 2.8122899 2.7014276 4.4338593 ] [ 4.68904 3.5083393 3.3680253 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9787451e-10 1.9966336e-10 2.401271e-10 ] [ 1.1974069e-10 4.2447485e-10 1.9658518e-10 ] [ 1.490932e-10 4.5847883e-10 4.3062586e-10 ] [ 3.5491591e-10 3.4531587e-10 1.275916e-10 ] [ 2.8122899e-10 2.7014276e-10 4.4338593e-10 ] [ 4.68904e-10 3.5083393e-10 3.3680253e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.91e-05 1.61e-05 2.37e-05 ] [ -8e-07 -7.9e-06 -1.09e-05 ] [ 2.31e-05 -1.67e-05 1.11e-05 ] [ 2.7e-06 4.8e-06 -7.8e-06 ] [ -2.99e-05 6.7e-06 -1.05e-05 ] [ -1.41e-05 -3e-06 -5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.060157345728e-14 2.579504359488e-14 3.797158591296e-14 ] [ -1.28174129664e-15 -1.265719530432e-14 -1.746372516672e-14 ] [ 3.701027994048e-14 -2.675634956736e-14 1.778416049088e-14 ] [ 4.32587687616e-15 7.69044777984e-15 -1.249697764224e-14 ] [ -4.790508096192e-14 1.073458335936e-14 -1.68228545184e-14 ] [ -2.259069035328e-14 -4.8065298624e-15 -9.13240673856e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.296262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.290513674123145e-18 } }