{ "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" [ [ 1.922149 2.490454 3.411092 ] [ 2.441615 3.416271 1.506229 ] [ 2.671317 4.814549 3.971801 ] [ 3.703717 1.527403 2.621349 ] [ 3.855488 2.690161 4.660198 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.922149e-10 2.490454e-10 3.411092e-10 ] [ 2.441615e-10 3.416271e-10 1.506229e-10 ] [ 2.671317e-10 4.814549e-10 3.971801e-10 ] [ 3.703717e-10 1.527403e-10 2.621349e-10 ] [ 3.855488e-10 2.690161e-10 4.660198e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.1095865 -0.0573388 4.5091439 ] [ 1.0282851 3.1308986 -2.8803091 ] [ -0.1416916 -0.4098521 -1.466876 ] [ 4.6001384 -3.6030346 -3.3826406 ] [ 2.6228546 0.939327 3.2206819 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.299299000170184e-08 -9.186688558159919e-11 7.224444995923632e-09 ] [ 1.647494360310353e-09 5.016252580343312e-09 -4.614763938717569e-09 ] [ -2.270149707540744e-10 -6.566554580158313e-10 -2.350194452175384e-09 ] [ 7.370234257646144e-09 -5.772697847613536e-09 -5.41958773053974e-09 ] [ 4.202276354499416e-09 1.504967771085318e-09 5.160101285726724e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.6753593 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.22972813280146e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5619303 2.3622192 3.6438613 ] [ 2.5805652 3.5589197 1.5211086 ] [ 2.7174853 4.7339105 3.7685148 ] [ 3.7986837 1.5543952 2.494891 ] [ 3.9356216 2.7293935 4.7422934 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5619303e-10 2.3622192e-10 3.6438613e-10 ] [ 2.5805652e-10 3.5589197e-10 1.5211086e-10 ] [ 2.7174853e-10 4.733910500000001e-10 3.7685148e-10 ] [ 3.7986837e-10 1.5543952e-10 2.494891e-10 ] [ 3.9356216e-10 2.7293935e-10 4.742293400000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.5e-06 -7.4e-06 -4.6e-06 ] [ -6.3e-06 -1.9e-06 2.7e-06 ] [ 1.09e-05 3.7e-06 -9e-07 ] [ 3e-06 7.2e-06 6.3e-06 ] [ -3.2e-06 -1.5e-06 -3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.209794853e-15 -1.18561070916e-14 -7.370012516399999e-15 ] [ -1.00937127942e-14 -3.0441356046e-15 4.3258769118e-15 ] [ 1.74637253106e-14 5.9280535458e-15 -1.4419589706e-15 ] [ 4.806529901999999e-15 1.15356717648e-14 1.00937127942e-14 ] [ -5.1269652288e-15 -2.403264951e-15 -5.607618218999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.338031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.656335170976765e-18 } }