{ "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" [ [ 1.305811 2.49596 1.153083 ] [ 2.737889 0.6120376 2.536176 ] [ 2.287817 4.454983 1.771215 ] [ 3.462438 1.614504 0.7986264 ] [ 3.194185 2.806829 3.238803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.305811e-10 2.49596e-10 1.153083e-10 ] [ 2.737889e-10 6.120375999999999e-11 2.536176e-10 ] [ 2.287817e-10 4.454983e-10 1.771215e-10 ] [ 3.462438e-10 1.614504e-10 7.986264e-11 ] [ 3.194185e-10 2.806829e-10 3.238803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3355883 -1.1240553 -2.2519303 ] [ -3.5223532 -7.6442352 8.6564886 ] [ 0.4879725 3.6793395 0.8054003 ] [ 5.7795358 2.6689881 -10.7140768 ] [ 1.5904333 2.4199629 3.5041182 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.946378211674017e-09 -1.80093512214633e-09 -3.607990078331131e-09 ] [ -5.643431947240066e-09 -1.224741492133641e-08 1.386922365314172e-08 ] [ 7.81818131093328e-10 5.894951726885963e-09 1.290393531045306e-09 ] [ 9.259837137836625e-09 4.276190335013412e-09 -1.716584336241568e-08 ] [ 2.548155050201793e-09 3.877207981583368e-09 5.614216256559779e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.2269222 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.15788057891805e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2713908 2.3127779 0.9888989 ] [ 2.488 0.9555164 2.6108179 ] [ 2.1678511 4.3646359 2.0125636 ] [ 3.6626494 1.3594742 0.2325854 ] [ 3.3982487 2.9919092 3.6530376 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2713908e-10 2.3127779e-10 9.888989000000001e-11 ] [ 2.488e-10 9.555164000000001e-11 2.6108179e-10 ] [ 2.1678511e-10 4.3646359e-10 2.0125636e-10 ] [ 3.6626494e-10 1.3594742e-10 2.325854e-11 ] [ 3.3982487e-10 2.9919092e-10 3.6530376e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.88e-05 -2.58e-05 -1.19e-05 ] [ -3.11e-05 4.77e-05 -3.54e-05 ] [ -2.76e-05 -1.84e-05 2.74e-05 ] [ -2.51e-05 -2.7e-06 3.63e-05 ] [ 3.5e-05 -8e-07 -1.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.818621909504e-14 -4.133615681664e-14 -1.906590178752e-14 ] [ -4.982769290688e-14 7.642382481215999e-14 -5.671705237632e-14 ] [ -4.422007473408001e-14 -2.948004982272e-14 4.389963940992e-14 ] [ -4.021463318208e-14 -4.32587687616e-15 5.815901133504e-14 ] [ 5.6076181728e-14 -1.28174129664e-15 -2.627569658112e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.065358 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.933083450918225e-18 } }