{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.109941 1.98713 2.733868 ] [ 1.585411 0.9055996 0.7031416 ] [ 2.255239 0.4517476 2.903783 ] [ 2.131264 2.335298 0.7662027 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.109941e-10 1.98713e-10 2.733868e-10 ] [ 1.585411e-10 9.055996e-11 7.031416000000001e-11 ] [ 2.255239e-10 4.517476000000001e-11 2.903783e-10 ] [ 2.131264e-10 2.335298e-10 7.662027e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.5487135 11.5977213 4.5657352 ] [ -17.0657295 -48.1422295 -5.999327 ] [ 7.8199718 -11.6109644 3.1592563 ] [ 18.7944712 48.1554726 -1.7256645 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.529872565446036e-08 1.85815980745041e-08 7.315114254471315e-09 ] [ -2.73423130470645e-08 -7.71323552135655e-08 -9.611981539125316e-09 ] [ 1.252897609649892e-08 -1.860281585988583e-08 5.061686624677294e-09 ] [ 3.011206260502594e-08 7.715357299894722e-08 -2.764819340023293e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 9.9095692 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.587688022524607e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4708685 2.4853066 3.0447333 ] [ 2.0700565 0.3545806 0.5087641 ] [ 1.8271556 0.1387222 2.8666285 ] [ 1.7137744 2.7011657 0.6868694 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4708685e-10 2.4853066e-10 3.0447333e-10 ] [ 2.0700565e-10 3.545806e-11 5.087641e-11 ] [ 1.8271556e-10 1.387222e-11 2.8666285e-10 ] [ 1.7137744e-10 2.7011657e-10 6.868694e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-06 2e-06 9e-07 ] [ 2.5e-06 -2e-06 -1.6e-06 ] [ -2.3e-06 5.8e-06 -5.5e-06 ] [ -2e-06 -5.9e-06 6.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.7237002778e-15 3.204353268e-15 1.4419589706e-15 ] [ 4.005441585e-15 -3.204353268e-15 -2.5634826144e-15 ] [ -3.685006258199999e-15 9.2926244772e-15 -8.811971486999999e-15 ] [ -3.204353268e-15 -9.452842140600001e-15 1.00937127942e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.6375609 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383889824873201e-18 } }