{ "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" "Si" ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -227.1163239 -347.0242946 -231.7143306 ] [ 11.7020408 -53.3075081 83.1733021 ] [ 569.7545849 448.1084705 572.6485458 ] [ 64.1312124 -44.8557365 18.4837066 ] [ 314.119571 -50.3900231 -796.0512305 ] [ -732.5910852 47.4690918 353.4600067 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.638804643546203e-07 -5.559942116577317e-07 -3.71247283191642e-07 ] [ 1.874873618540773e-08 -8.540804319092663e-08 1.332583200993555e-07 ] [ 9.128474755203888e-07 7.179489150175465e-07 9.17484112015878e-07 ] [ 1.02749529170839e-07 -7.186681232906522e-08 2.961416258024666e-08 ] [ 5.032750327919257e-07 -8.073371693239194e-08 -1.275414670466172e-06 ] [ -1.173740309313941e-06 7.6053869092569e-08 5.663053591225514e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 188.90063 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.026521730403911e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.0404555 1.3252361 0.2243368 ] [ 0.7324599 -0.1877838 2.5940572 ] [ 0.1132977 2.6529315 2.8158254 ] [ 3.3825387 0.4266866 2.12205 ] [ 2.6096249 1.9396727 -0.2476982 ] [ 2.7633674 3.2674131 2.34377 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.04555e-12 1.3252361e-10 2.243368e-11 ] [ 7.324599e-11 -1.877838e-11 2.5940572e-10 ] [ 1.132977e-11 2.6529315e-10 2.8158254e-10 ] [ 3.3825387e-10 4.266866e-11 2.12205e-10 ] [ 2.6096249e-10 1.9396727e-10 -2.476982e-11 ] [ 2.7633674e-10 3.2674131e-10 2.34377e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.07e-05 -1.62e-05 -3.7e-06 ] [ -1.94e-05 -2.28e-05 3.18e-05 ] [ -2.61e-05 2.41e-05 -2.1e-06 ] [ 1.39e-05 3.42e-05 -2.94e-05 ] [ 4.39e-05 2.7e-05 1.5e-05 ] [ 1.84e-05 -4.63e-05 -1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.918682225856e-14 -2.595526125696e-14 -5.928053496960001e-15 ] [ -3.108222644352e-14 -3.652962695424e-14 5.094921654144e-14 ] [ -4.181680980288e-14 3.861245656128e-14 -3.36457090368e-15 ] [ 2.227025502912e-14 5.479444043136e-14 -4.710399265152e-14 ] [ 7.033555365312e-14 4.32587687616e-14 2.4032649312e-14 ] [ 2.948004982272e-14 -7.418077754303999e-14 -1.858524880128e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.010417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.565151580665888e-18 } }