{ "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" [ [ 3.032432 2.348999 1.593337 ] [ 4.810482 1.062628 3.508091 ] [ 5.121871 3.223017 1.668157 ] [ 3.284691 4.649431 1.699114 ] [ 3.943916 3.285754 3.641374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.032432e-10 2.348999e-10 1.593337e-10 ] [ 4.810482000000001e-10 1.062628e-10 3.508091e-10 ] [ 5.121871e-10 3.223017e-10 1.668157e-10 ] [ 3.284691e-10 4.649431e-10 1.699114e-10 ] [ 3.943916e-10 3.285754e-10 3.641374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -27.5150581 -30.794597 -12.1994654 ] [ 1.7982658 -4.9451318 0.5431377 ] [ 40.9023233 -0.7861022 -12.8654894 ] [ -13.141335 32.7157417 -6.8134457 ] [ -2.044196 3.8100892 31.3352628 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.408398317097243e-08 -4.93383837668465e-08 -1.954569841117146e-08 ] [ 2.881139446481317e-09 -7.922974622010362e-09 8.702025319845016e-10 ] [ 6.553274666757376e-08 -1.259474576775995e-09 -2.061278650165468e-08 ] [ -2.105473987656639e-08 5.241639691571944e-08 -1.091634349756777e-08 ] [ -3.275163066516263e-09 6.104435889695752e-09 5.02046258784094e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.4320006 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.49867116919398e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.8495126 2.0906796 1.6721208 ] [ 4.8078252 1.0837725 3.2116355 ] [ 5.4530828 3.1787874 1.658086 ] [ 3.2695298 4.7441604 1.6323998 ] [ 3.8134417 3.4724291 3.9358308 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8495126e-10 2.0906796e-10 1.6721208e-10 ] [ 4.8078252e-10 1.0837725e-10 3.2116355e-10 ] [ 5.4530828e-10 3.1787874e-10 1.658086e-10 ] [ 3.2695298e-10 4.7441604e-10 1.6323998e-10 ] [ 3.8134417e-10 3.4724291e-10 3.9358308e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-06 9e-07 1.48e-05 ] [ 5e-07 5.2e-06 -1.42e-05 ] [ -3.4e-06 -4.1e-06 1.4e-05 ] [ -7e-07 5.2e-06 -1.38e-05 ] [ 5e-07 -7.2e-06 -8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.806529901999999e-15 1.4419589706e-15 2.37122141832e-14 ] [ 8.010883169999999e-16 8.331318496799998e-15 -2.27509082028e-14 ] [ -5.4474005556e-15 -6.568924199399999e-15 2.243047287599999e-14 ] [ -1.1215236438e-15 8.331318496799998e-15 -2.21100375492e-14 ] [ 8.010883169999999e-16 -1.15356717648e-14 -1.2817413072e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.92185 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.71117926740529e-18 } }