{ "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" [ [ 0.0562169 0.1968178 1.270009 ] [ 0.319021 0.1442605 2.935142 ] [ 0.1524012 2.469722 2.823059 ] [ 2.088827 0.2993275 0.454611 ] [ 2.473305 0.2789971 2.995912 ] [ 2.138376 2.393894 2.931206 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.62169e-12 1.968178e-11 1.270009e-10 ] [ 3.19021e-11 1.442605e-11 2.935142e-10 ] [ 1.524012e-11 2.469722e-10 2.823059e-10 ] [ 2.088827e-10 2.993275e-11 4.54611e-11 ] [ 2.473305e-10 2.789971e-11 2.995912e-10 ] [ 2.138376e-10 2.393894e-10 2.931206e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5106704 -5.1899948 -29.8828714 ] [ -0.28955 -1.0690636 26.7161599 ] [ -7.6120916 6.0610715 3.6368186 ] [ 2.7412224 -0.2305701 2.29019 ] [ 4.2432853 -3.1734001 -3.4495324 ] [ 7.4278042 3.6019572 0.6892353 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.043124398655543e-08 -8.315288399141502e-09 -4.787763831390686e-08 ] [ -4.639102443747e-10 -1.712828720179922e-09 4.280400714198777e-08 ] [ -1.219591529738767e-08 9.71090713430333e-09 5.826825783016591e-09 ] [ 4.391922477877401e-09 -3.694140267190433e-10 3.66928890542046e-09 ] [ 6.79849255905568e-09 -5.084347490553263e-09 -5.526760209505942e-09 ] [ 1.190065433116706e-08 5.770971662508064e-09 1.10427669298798e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0967744 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.165932852449369e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.090457 -0.3967233 0.6455495 ] [ 0.0619392 0.4137173 2.8781784 ] [ 0.0682868 2.6913628 3.5688056 ] [ 2.2607494 -0.2762483 0.3905896 ] [ 2.5081294 0.5390697 2.6129225 ] [ 2.4194993 2.8118408 3.3138934 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.0457e-12 -3.967233e-11 6.455495e-11 ] [ 6.19392e-12 4.137173000000001e-11 2.8781784e-10 ] [ 6.82868e-12 2.6913628e-10 3.5688056e-10 ] [ 2.2607494e-10 -2.762483e-11 3.905896e-11 ] [ 2.5081294e-10 5.390697e-11 2.6129225e-10 ] [ 2.4194993e-10 2.8118408e-10 3.3138934e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.67e-05 -2.45e-05 -1.79e-05 ] [ -1.68e-05 1.55e-05 -1.08e-05 ] [ -4.5e-06 8e-06 3.4e-05 ] [ 1.88e-05 1.26e-05 2.54e-05 ] [ 1.36e-05 1.27e-05 -6.2e-06 ] [ 5.5e-06 -2.43e-05 -2.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.67563497878e-14 -3.925332753299999e-14 -2.86789617486e-14 ] [ -2.691656745119999e-14 2.4833737827e-14 -1.73035076472e-14 ] [ -7.209794853e-15 1.2817413072e-14 5.447400555599999e-14 ] [ 3.012092071919999e-14 2.01874255884e-14 4.06952865036e-14 ] [ 2.17896022224e-14 2.03476432518e-14 -9.9334951308e-15 ] [ 8.811971486999999e-15 -3.893289220619999e-14 -3.925332753299999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.840897 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.37777384010007e-18 } }