{ "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" [ [ 1.558502 1.467528 2.474942 ] [ 1.379624 2.873279 4.407553 ] [ 1.24144 3.597751 1.918679 ] [ 3.591005 1.301821 3.64335 ] [ 3.465479 3.687448 2.931727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.558502e-10 1.467528e-10 2.474942e-10 ] [ 1.379624e-10 2.873279e-10 4.407553e-10 ] [ 1.24144e-10 3.597751e-10 1.918679e-10 ] [ 3.591005e-10 1.301821e-10 3.64335e-10 ] [ 3.465479e-10 3.687448e-10 2.931727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.7863279 -0.1080497 -0.8905234 ] [ 2.5477269 -0.1189557 2.451518 ] [ -1.4113609 3.1997148 -3.0139385 ] [ -0.6767432 1.1429036 1.1760567 ] [ -3.2459507 -4.1156129 0.2768872 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.464189456042288e-09 -1.731147046507098e-10 -1.426775783510235e-09 ] [ 4.081908508993254e-09 -1.905880430211138e-10 3.927764857430412e-09 ] [ -2.261249456121211e-09 5.126508288023983e-09 -4.828861841013009e-09 ] [ -1.084262142258389e-09 1.831133442834482e-09 1.884250564999148e-09 ] [ -5.200586366655943e-09 -6.593938822968978e-09 4.436222020936848e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -14.041585 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.249709939132489e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.809032 1.4633295 2.1994995 ] [ 1.5283722 2.8593114 4.3506671 ] [ 0.955254 3.8740501 2.0705385 ] [ 3.5391658 1.2970811 4.0799608 ] [ 3.404226 3.4340549 2.6755851 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.809032e-10 1.4633295e-10 2.1994995e-10 ] [ 1.5283722e-10 2.8593114e-10 4.3506671e-10 ] [ 9.552540000000001e-11 3.8740501e-10 2.0705385e-10 ] [ 3.5391658e-10 1.2970811e-10 4.079960800000001e-10 ] [ 3.404226e-10 3.4340549e-10 2.6755851e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.4e-06 8.2e-06 -1.1e-05 ] [ -1.58e-05 1.43e-05 -6.4e-06 ] [ 2.03e-05 -2.19e-05 1.99e-05 ] [ 1.14e-05 -1.04e-05 7.2e-06 ] [ -6.5e-06 9.7e-06 -9.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.50604603596e-14 1.31378483988e-14 -1.7623942974e-14 ] [ -2.53143908172e-14 2.29111258662e-14 -1.02539304576e-14 ] [ 3.252418567019999e-14 -3.50876682846e-14 3.18833150166e-14 ] [ 1.82648136276e-14 -1.66626369936e-14 1.15356717648e-14 ] [ -1.0414148121e-14 1.55411133498e-14 -1.55411133498e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.582415215248651e-18 } }