{ "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" [ [ 3.046952 0.8888341 2.154791 ] [ 1.482397 2.148474 3.156267 ] [ 1.59563 3.780951 1.691413 ] [ 3.247494 1.676883 4.588179 ] [ 3.703607 3.217806 2.519536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.046952e-10 8.888341e-11 2.154791e-10 ] [ 1.482397e-10 2.148474e-10 3.156267e-10 ] [ 1.59563e-10 3.780951e-10 1.691413e-10 ] [ 3.247494e-10 1.676883e-10 4.588179e-10 ] [ 3.703607e-10 3.217806e-10 2.519536e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0616015 0.5528098 0.8547246 ] [ -0.3921938 -0.6683998 1.5138534 ] [ 0.3313266 1.5046965 -1.2069034 ] [ 0.3007704 0.6132675 -2.3910574 ] [ -1.3015047 -2.002374 1.2293828 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.700873117919351e-09 8.856989446062131e-10 1.369419782624996e-09 ] [ -6.283637423596691e-10 -1.070894541730273e-09 2.425460544781455e-09 ] [ 5.308437367426644e-10 2.410789573561581e-09 -1.933672426975155e-09 ] [ 4.818873070788336e-10 9.825628588915948e-10 -3.830896296832792e-09 ] [ -2.08524041938118e-09 -3.208156835329116e-09 1.969688396401495e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.23955 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.92229808246747e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1136751 0.8758523 2.2248739 ] [ 1.4462812 2.1857784 3.2035187 ] [ 1.6104907 3.864061 1.5853726 ] [ 3.3481173 1.658158 4.4475958 ] [ 3.5575158 3.1290984 2.648825 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1136751e-10 8.758523e-11 2.2248739e-10 ] [ 1.4462812e-10 2.1857784e-10 3.2035187e-10 ] [ 1.6104907e-10 3.864061e-10 1.5853726e-10 ] [ 3.3481173e-10 1.658158e-10 4.4475958e-10 ] [ 3.5575158e-10 3.1290984e-10 2.648825e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.7e-06 5e-06 6.9e-06 ] [ 5.8e-06 -1.82e-05 -6.1e-06 ] [ 1.31e-05 1.22e-05 4e-07 ] [ 6.7e-06 -6.5e-06 1.86e-05 ] [ -1.69e-05 7.5e-06 -1.99e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.39389367158e-14 8.010883169999999e-15 1.10550187746e-14 ] [ 9.2926244772e-15 -2.915961473879999e-14 -9.773277467399999e-15 ] [ 2.09885139054e-14 1.95465549348e-14 6.408706536e-16 ] [ 1.07345834478e-14 -1.0414148121e-14 2.98004853924e-14 ] [ -2.70767851146e-14 1.2016324755e-14 -3.18833150166e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.979559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.04086059534244e-18 } }