{ "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" [ [ 2.441642 1.737365 1.840337 ] [ 1.815126 3.688812 0.8905128 ] [ 2.603472 3.479991 3.236515 ] [ 3.869651 3.231599 1.101882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.441642e-10 1.737365e-10 1.840337e-10 ] [ 1.815126e-10 3.688812e-10 8.905128000000001e-11 ] [ 2.603472e-10 3.479991e-10 3.236515e-10 ] [ 3.869651e-10 3.231599e-10 1.101882e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7445272 -33.0284683 5.44531 ] [ -20.6537727 18.3592336 -22.3640425 ] [ -2.5703002 8.6428485 34.3827246 ] [ 28.9686 6.0263863 -17.463992 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.203747177389688e-09 -5.291743973109392e-08 8.72434837500845e-09 ] [ -3.30909917512573e-08 2.941473484972582e-08 -3.583114604007759e-08 ] [ -4.118074888877564e-09 1.384736980381635e-08 5.508719751352504e-08 ] [ 4.641281365730687e-08 9.655335237769415e-09 -2.798039968823824e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.062491965 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.001231653108519e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.3711303 1.4946686 1.8040489 ] [ 1.604616 3.7659537 0.8885053 ] [ 2.6461146 3.6111907 3.2285523 ] [ 4.1080301 3.265954 1.1481403 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3711303e-10 1.4946686e-10 1.8040489e-10 ] [ 1.604616e-10 3.7659537e-10 8.885053e-11 ] [ 2.6461146e-10 3.6111907e-10 3.2285523e-10 ] [ 4.1080301e-10 3.265954e-10 1.1481403e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.23e-05 6.7e-06 -3.6e-06 ] [ 1.6e-06 -1.41e-05 3.1e-06 ] [ 9e-06 -1.4e-06 -8e-06 ] [ 1.7e-06 8.8e-06 8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.970677243584e-14 1.073458335936e-14 -5.76783583488e-15 ] [ 2.56348259328e-15 -2.259069035328e-14 4.96674752448e-15 ] [ 1.44195895872e-14 -2.24304726912e-15 -1.28174129664e-14 ] [ 2.72370025536e-15 1.409915426304e-14 1.36185012768e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.416056 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.989271464574356e-18 } }