{ "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" [ [ 1.178267 0.166744 1.149708 ] [ 0.7840536 2.31607 1.236295 ] [ 0.8079908 1.595267 2.952936 ] [ 2.817536 1.157767 1.902801 ] [ 1.934708 2.772369 0.0108268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.178267e-10 1.66744e-11 1.149708e-10 ] [ 7.840536e-11 2.31607e-10 1.236295e-10 ] [ 8.079908000000001e-11 1.595267e-10 2.952936e-10 ] [ 2.817536e-10 1.157767e-10 1.902801e-10 ] [ 1.934708e-10 2.772369e-10 1.08268e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2200767 -8.5859672 -4.7795437 ] [ -19.6695823 4.3274253 1.8800927 ] [ -3.3514944 -7.1127231 23.543605 ] [ 8.7344027 3.2733509 1.9145133 ] [ 19.5067508 8.0979142 -22.5586673 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.363484916427826e-09 -1.375623602813041e-08 -7.657673237321904e-09 ] [ -3.151414516159997e-08 6.93329970104044e-09 3.012240593693971e-09 ] [ -5.369686016661849e-09 -1.139583875493205e-08 3.772101381112556e-08 ] [ 1.399405591788651e-08 5.244486326862871e-09 3.067388474742232e-09 ] [ 3.12532603370208e-08 1.29742889153768e-08 -3.614296964223986e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.1377199 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.822828239816817e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1349549 0.2907545 0.8938518 ] [ 0.5396282 2.7120429 1.4207141 ] [ 0.8090789 1.0449257 3.223216 ] [ 2.8389558 1.8021288 2.0369747 ] [ 2.1999376 2.158365 -0.3221898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1349549e-10 2.907545e-11 8.938518e-11 ] [ 5.396282e-11 2.7120429e-10 1.4207141e-10 ] [ 8.090789e-11 1.0449257e-10 3.223216e-10 ] [ 2.8389558e-10 1.8021288e-10 2.0369747e-10 ] [ 2.1999376e-10 2.158365e-10 -3.221898000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.4e-06 4.3e-05 3.1e-06 ] [ 2.56e-05 -3.12e-05 -4.5e-06 ] [ 2.43e-05 -1.7e-06 -3.8e-06 ] [ -4.88e-05 9e-07 5.3e-06 ] [ 1.2e-06 -1.1e-05 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.845223921599999e-15 6.889359526199999e-14 4.9667475654e-15 ] [ 4.10157218304e-14 -4.998791098079999e-14 -7.209794853e-15 ] [ 3.893289220619999e-14 -2.7237002778e-15 -6.088271209199999e-15 ] [ -7.818621973919999e-14 1.4419589706e-15 8.4915361602e-15 ] [ 1.9226119608e-15 -1.7623942974e-14 -1.602176634e-16 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }