{ "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" [ [ 1.60665 2.271209 0.858315 ] [ 1.14021 1.706761 3.269891 ] [ 0.6855745 3.746661 2.498398 ] [ 2.590166 5.193842 1.980174 ] [ 3.090456 3.322533 2.927067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60665e-10 2.271209e-10 8.58315e-11 ] [ 1.14021e-10 1.706761e-10 3.269891e-10 ] [ 6.855745e-11 3.746661e-10 2.498398e-10 ] [ 2.590166e-10 5.193842e-10 1.980174e-10 ] [ 3.090456e-10 3.322533e-10 2.927067e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.651952 -1.9190463 -8.71597 ] [ -1.7578301 -8.8816117 7.4079468 ] [ -7.0145475 6.446522 -1.5029791 ] [ -0.4885997 10.0530096 -4.2289367 ] [ 9.9129293 -5.6988737 7.039939 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.044542260889568e-09 -3.074651141424154e-09 -1.396452347664498e-08 ] [ -2.816354312761883e-09 -1.422991073800102e-08 1.186883926887507e-08 ] [ -1.123854410258311e-08 1.032846691896695e-08 -2.408037995410349e-09 ] [ -7.828230227194097e-10 1.610669708249768e-08 -6.775503567405067e-09 ] [ 1.588226369895398e-08 -9.130602282257125e-09 1.127922577058533e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3742928 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.021274298243443e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7417616 2.3856986 -0.1011727 ] [ 1.521495 1.902116 3.6915281 ] [ 0.6391834 3.5075626 2.0153196 ] [ 2.6014858 5.0273661 2.0873387 ] [ 3.6091308 3.4182627 3.8408313 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.417616e-11 2.3856986e-10 -1.011727e-11 ] [ 1.521495e-10 1.902116e-10 3.6915281e-10 ] [ 6.391834e-11 3.5075626e-10 2.0153196e-10 ] [ 2.6014858e-10 5.027366100000001e-10 2.0873387e-10 ] [ 3.6091308e-10 3.4182627e-10 3.8408313e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.26e-05 -3.21e-05 -6.59e-05 ] [ -1.85e-05 -1.02e-05 2.24e-05 ] [ -2.46e-05 4.24e-05 7.12e-05 ] [ 1.14e-05 -2.3e-05 3.14e-05 ] [ -9e-07 2.29e-05 -5.91e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.22309582684e-14 -5.14298699514e-14 -1.055834401806e-13 ] [ -2.9640267729e-14 -1.63422016668e-14 3.588875660159999e-14 ] [ -3.94135451964e-14 6.79322892816e-14 1.140749763408e-13 ] [ 1.82648136276e-14 -3.6850062582e-14 5.030834630759999e-14 ] [ -1.4419589706e-15 3.66898449186e-14 -9.468863906939999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196954159838e-18 } }