{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.05366e-12 9.817075e-11 2.996189e-11 ] [ 8.35419e-11 3.20426e-12 2.4553927e-10 ] [ 4.936792e-11 2.5904191e-10 2.2866821e-10 ] [ 3.169189e-10 6.05667e-11 2.0618446e-10 ] [ 2.177259e-10 2.128236e-10 2.209491e-11 ] [ 2.9758234e-10 3.086084e-10 2.527854e-10 ] ] "source-value" [ [ -0.0905366 0.9817075 0.2996189 ] [ 0.835419 0.0320426 2.4553927 ] [ 0.4936792 2.5904191 2.2866821 ] [ 3.169189 0.605667 2.0618446 ] [ 2.177259 2.128236 0.2209491 ] [ 2.9758234 3.086084 2.527854 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.6685008843904e-13 -1.57445896526016e-12 2.40278427821376e-12 ] [ -8.6133015134208e-13 6.0890722473504e-12 -8.047733166278401e-13 ] [ 1.36489426325952e-12 -1.45621833064512e-12 -3.90722812514496e-12 ] [ 1.9891022747232e-12 3.13321659963648e-12 -3.64479159465792e-12 ] [ -1.2064389954624e-12 -1.21188639597312e-12 3.7843411783296e-12 ] [ -1.85307747961728e-12 -4.979725155108481e-12 2.16966757988736e-12 ] ] "source-value" [ [ 0.0003538 -0.0009827 0.0014997 ] [ -0.0005376 0.0038005 -0.0005023 ] [ 0.0008519 -0.0009089 -0.0024387 ] [ 0.0012415 0.0019556 -0.0022749 ] [ -0.000753 -0.0007564 0.002362 ] [ -0.0011566 -0.0031081 0.0013542 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "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" -2.188211332314161e-18 "source-value" -13.657741 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.257373215630669e-08 -1.434638277282474e-08 -3.522037452262658e-08 ] [ -4.877406791533289e-09 -1.359745716753878e-08 3.196311067986596e-08 ] [ -6.424401084942033e-09 2.398748956067782e-08 1.364504373578848e-08 ] [ 1.906018442024868e-08 -1.512160378146427e-08 4.365046890185318e-10 ] [ 1.5379801273048e-09 1.504960901370265e-08 -2.11022742006103e-08 ] [ 3.277375325010878e-09 4.028345147447322e-09 1.027798961856391e-08 ] ] "source-value" [ [ -7.8479064 -8.9543079 -21.9828289 ] [ -3.0442379 -8.4868653 19.9498047 ] [ -4.0097958 14.9718135 8.5165665 ] [ 11.8964315 -9.4381628 0.2724448 ] [ 0.9599317 9.3932272 -13.1710037 ] [ 2.0455768 2.5142953 6.4150166 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.442518887405437e-20 "source-value" -0.090034948 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.314663000000001e-11 9.036294e-11 7.794334000000001e-11 ] [ 1.004832e-10 4.139501e-11 2.5602e-10 ] [ 3.021018e-11 2.478458e-10 1.913452e-10 ] [ 2.709186e-10 4.632097e-11 1.441964e-10 ] [ 2.312911e-10 2.26354e-10 6.044428e-11 ] [ 2.800336e-10 2.901369e-10 2.552849e-10 ] ] "source-value" [ [ 0.4314663 0.9036294 0.7794334 ] [ 1.004832 0.4139501 2.5602 ] [ 0.3021018 2.478458 1.913452 ] [ 2.709186 0.4632097 1.441964 ] [ 2.312911 2.26354 0.6044428 ] [ 2.800336 2.901369 2.552849 ] ] } "instance-id" 1 }