{ "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" [ [ 0.2517942 1.00813 0.5908488 ] [ 0.7479483 2.057521 2.479291 ] [ 2.193445 0.0782553 1.774549 ] [ 2.171144 2.200702 0.4838172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.517942e-11 1.00813e-10 5.908487999999999e-11 ] [ 7.479483e-11 2.057521e-10 2.479291e-10 ] [ 2.193445e-10 7.82553e-12 1.774549e-10 ] [ 2.171144e-10 2.200702e-10 4.838172e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1060428 -3.5917424 -4.2590998 ] [ -0.1328005 2.5398826 5.1026773 ] [ 1.3525231 -1.8555238 0.9704936 ] [ 3.8863202 2.9073835 -1.8140712 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.18078239896417e-09 -5.754605701216081e-09 -6.823830125213957e-09 ] [ -2.127698563305504e-10 4.069340521296718e-09 8.175390273546867e-09 ] [ 2.16698088991194e-09 -2.972876851697975e-09 1.554902156556027e-09 ] [ 6.226571365382781e-09 4.658141871399677e-09 -2.906462465106601e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5914096 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.95842573843668e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0940026 0.8561358 0.4405219 ] [ 0.8036221 2.1283632 2.6221349 ] [ 2.1863901 0.0544366 1.8046148 ] [ 2.2803168 2.3056728 0.4612343 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.400260000000001e-12 8.561358e-11 4.405219e-11 ] [ 8.036221e-11 2.1283632e-10 2.6221349e-10 ] [ 2.1863901e-10 5.443660000000001e-12 1.8046148e-10 ] [ 2.2803168e-10 2.3056728e-10 4.612343e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.3e-06 -1.4e-06 -2.4e-06 ] [ -1e-06 1.4e-06 2.8e-06 ] [ 2.3e-06 -2.5e-06 1.5e-06 ] [ 3e-06 2.5e-06 -1.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.889359469440001e-15 -2.24304726912e-15 -3.84522388992e-15 ] [ -1.6021766208e-15 2.24304726912e-15 4.48609453824e-15 ] [ 3.68500622784e-15 -4.005441552e-15 2.4032649312e-15 ] [ 4.8065298624e-15 4.005441552e-15 -3.04413557952e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.0898797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.135923949962452e-18 } }