{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9925273 0.3379082 1.803379 ] [ 1.204741 2.296652 0.0005587 ] [ 2.970089 0.0748089 0.2894365 ] [ 2.914059 2.502311 2.040612 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.925273e-11 3.379082e-11 1.803379e-10 ] [ 1.204741e-10 2.296652e-10 5.587e-14 ] [ 2.970089000000001e-10 7.48089e-12 2.894365e-11 ] [ 2.914059e-10 2.502311e-10 2.040612e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4159306 1.6151483 -0.7143775 ] [ 2.3778979 -2.5534962 1.7563793 ] [ -2.0310675 2.0625017 -0.0120758 ] [ -1.7627611 -1.1241539 -1.029926 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.2685709226856e-09 2.587752866704822e-09 -1.144558938355335e-09 ] [ 3.809812453417668e-09 -4.091151946647791e-09 2.814029874901276e-09 ] [ -3.254128890576795e-09 3.304492031325278e-09 -1.934756459685719e-11 ] [ -2.824254645744137e-09 -1.801093111599972e-09 -1.650123371949084e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7305917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.181420120734336e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9649143 0.471595 1.9141401 ] [ 1.2328727 2.1888986 -0.0507095 ] [ 3.0070977 0.2848295 0.2782407 ] [ 2.8765316 2.2663571 1.9923149 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.649143e-11 4.71595e-11 1.9141401e-10 ] [ 1.2328727e-10 2.1888986e-10 -5.07095e-12 ] [ 3.0070977e-10 2.848295e-11 2.782407e-11 ] [ 2.8765316e-10 2.2663571e-10 1.9923149e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.6e-06 6.4e-06 -6.2e-06 ] [ 2.7e-06 -5.8e-06 7.8e-06 ] [ -2.6e-06 -3.7e-06 -3.6e-06 ] [ -4.7e-06 3.1e-06 2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.370012516399999e-15 1.02539304576e-14 -9.9334951308e-15 ] [ 4.3258769118e-15 -9.2926244772e-15 1.24969777452e-14 ] [ -4.165659248399999e-15 -5.9280535458e-15 -5.767835882399999e-15 ] [ -7.530230179799999e-15 4.9667475654e-15 3.204353268e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.0898797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.135923959321093e-18 } }