{ "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" [ [ 3.032432 2.348999 1.593337 ] [ 4.810482 1.062628 3.508091 ] [ 5.121871 3.223017 1.668157 ] [ 3.284691 4.649431 1.699114 ] [ 3.943916 3.285754 3.641374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.032432e-10 2.348999e-10 1.593337e-10 ] [ 4.810482000000001e-10 1.062628e-10 3.508091e-10 ] [ 5.121871e-10 3.223017e-10 1.668157e-10 ] [ 3.284691e-10 4.649431e-10 1.699114e-10 ] [ 3.943916e-10 3.285754e-10 3.641374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.313101 2.2052369 1.5660284 ] [ -0.0334491 0.5580667 1.9442085 ] [ -0.359817 1.7883264 -0.2602503 ] [ 2.0803024 -4.0152654 3.9980316 ] [ -1.3739352 -0.5363647 -7.2480182 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.01643106282034e-10 3.533179033614594e-09 2.509054110660406e-09 ] [ -5.35913664483294e-11 8.941214269534878e-10 3.114965430324189e-09 ] [ -5.764903899159779e-10 2.865214772045337e-09 -4.169669496514901e-10 ] [ 3.333011896934121e-09 -6.433164403188662e-09 6.405552811513634e-09 ] [ -2.201286874070116e-09 -8.593509896424197e-10 -1.161260540284674e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.063743046368849 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.772607059347215e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9678035 2.3409531 1.5232513 ] [ 4.7737559 1.1624177 3.6612169 ] [ 5.1986715 3.2785028 1.5251116 ] [ 3.3258975 4.6110607 1.8873185 ] [ 3.9272636 3.1768947 3.5131747 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9678035e-10 2.3409531e-10 1.5232513e-10 ] [ 4.773755900000001e-10 1.1624177e-10 3.6612169e-10 ] [ 5.1986715e-10 3.2785028e-10 1.5251116e-10 ] [ 3.3258975e-10 4.6110607e-10 1.8873185e-10 ] [ 3.9272636e-10 3.1768947e-10 3.5131747e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.81e-05 7.78e-05 -1.09e-05 ] [ 1.91e-05 -1.76e-05 5.5e-06 ] [ -0.0001282 3.23e-05 7.14e-05 ] [ 8.01e-05 -0.0001607 2.39e-05 ] [ 1.09e-05 6.82e-05 -8.99e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.899939707539999e-14 1.246493421252e-13 -1.74637253106e-14 ] [ 3.06015737094e-14 -2.81983087584e-14 8.811971486999999e-15 ] [ -2.053990444788e-13 5.17503052782e-14 1.143954116676e-13 ] [ 1.283343483834e-13 -2.574697850838e-13 3.82920215526e-14 ] [ 1.74637253106e-14 1.092684464388e-13 -1.440356793966e-13 ] ] } "relaxed-potential-energy" { "source-value" -12.33375504636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.976085414477176e-18 } }