{ "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" [ [ 1.198213 1.350624 3.055818 ] [ 2.6169 3.019665 1.923407 ] [ 3.04509 0.4771157 2.258597 ] [ 0.8976629 3.617369 3.27072 ] [ 3.817629 1.77083 3.542328 ] [ 3.146341 4.405242 3.880584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.198213e-10 1.350624e-10 3.055818e-10 ] [ 2.6169e-10 3.019665e-10 1.923407e-10 ] [ 3.04509e-10 4.771157e-11 2.258597e-10 ] [ 8.976629000000001e-11 3.617369e-10 3.27072e-10 ] [ 3.817629e-10 1.77083e-10 3.542328e-10 ] [ 3.146341e-10 4.405242e-10 3.880584e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.2530197 -7.7557842 6.6353951 ] [ 7.4641203 5.2032509 -16.798308 ] [ -5.3260589 -29.106821 -26.4138419 ] [ -9.7273613 5.9528567 4.4133043 ] [ 18.9380309 23.9598398 27.1778367 ] [ 4.9042889 1.7466578 4.9856139 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.604020839528168e-08 -1.242613622358638e-08 1.063107498657809e-08 ] [ 1.195883913802507e-08 8.336527012819468e-09 -2.691385656833526e-08 ] [ -8.533287120887741e-09 -4.663426849622051e-08 -4.231964030635017e-08 ] [ -1.558495098533586e-08 9.537527910290348e-09 7.070893028191726e-09 ] [ 3.034207060194999e-08 3.838789548194323e-08 4.354369492340767e-08 ] [ 7.857537081965561e-09 2.798454314753845e-09 7.98783409672561e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8235903 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.33042030464905e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5976223 1.3001183 2.5795503 ] [ 2.6435161 2.9082022 1.7262769 ] [ 2.9944039 0.3300032 2.5803644 ] [ 0.7133123 3.7163356 3.4928928 ] [ 4.5913882 2.1466598 3.4941954 ] [ 3.1815932 4.2395266 4.0581742 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.976223e-11 1.3001183e-10 2.5795503e-10 ] [ 2.6435161e-10 2.9082022e-10 1.7262769e-10 ] [ 2.9944039e-10 3.300032e-11 2.5803644e-10 ] [ 7.133123e-11 3.7163356e-10 3.4928928e-10 ] [ 4.5913882e-10 2.1466598e-10 3.4941954e-10 ] [ 3.1815932e-10 4.2395266e-10 4.0581742e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.4e-06 -1.2e-06 6e-07 ] [ -1.7e-06 1.1e-06 -4e-07 ] [ 1e-07 6e-07 -4e-07 ] [ -3.3e-06 2e-07 -1.3e-06 ] [ -1.2e-06 -2.2e-06 6e-07 ] [ 3.7e-06 1.6e-06 8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.845223921599999e-15 -1.9226119608e-15 9.613059803999998e-16 ] [ -2.7237002778e-15 1.7623942974e-15 -6.408706536e-16 ] [ 1.602176634e-16 9.613059803999998e-16 -6.408706536e-16 ] [ -5.2871828922e-15 3.204353268e-16 -2.0828296242e-15 ] [ -1.9226119608e-15 -3.5247885948e-15 9.613059803999998e-16 ] [ 5.9280535458e-15 2.5634826144e-15 1.2817413072e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.748298 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.164026161686893e-18 } }