{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.525507e-11 2.51129e-10 2.0963157e-10 ] [ 2.1450245e-10 6.122523e-11 1.6861551e-10 ] [ 2.8641535e-10 2.789570900000001e-10 1.0110982e-10 ] ] "source-value" [ [ 0.7525507 2.51129 2.0963157 ] [ 2.1450245 0.6122523 1.6861551 ] [ 2.8641535 2.7895709 1.0110982 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.0265116366912e-13 3.893289188544e-13 -2.066807840832e-13 ] [ 1.1663845799424e-13 -6.727539630739201e-13 4.101572149248001e-14 ] [ -4.192896216633601e-13 2.8342504421952e-13 1.658252802528e-13 ] ] "source-value" [ [ 0.0001889 0.000243 -0.000129 ] [ 7.28e-05 -0.0004199 2.56e-05 ] [ -0.0002617 0.0001769 0.0001035 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.335833118536075e-18 "source-value" -8.3376146 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.091185619156842e-09 2.052021352798637e-10 5.096004725539661e-10 ] [ -1.529445973316446e-09 -5.832145602262291e-09 1.611940925997804e-09 ] [ 2.620631592473288e-09 5.626943466982427e-09 -2.12154139855177e-09 ] ] "source-value" [ [ -0.6810645 0.1280771 0.3180676 ] [ -0.9546051 -3.640139 1.0060944 ] [ 1.6356696 3.5120619 -1.324162 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.228830727522909e-18 "source-value" -7.6697582 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.252086e-11 2.552897e-10 2.103736e-10 ] [ 2.233995e-10 7.543773000000001e-11 1.621303e-10 ] [ 2.802525e-10 2.605839e-10 1.06853e-10 ] ] "source-value" [ [ 0.7252086 2.552897 2.103736 ] [ 2.233995 0.7543773 1.621303 ] [ 2.802525 2.605839 1.06853 ] ] } "instance-id" 1 }