{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.816977 2.980856 2.674074 ] [ 1.919186 2.00454 4.634036 ] [ 0.9862405 4.087254 4.422598 ] [ 4.092598 2.125916 2.093906 ] [ 4.150721 2.426451 4.257829 ] [ 3.183229 4.446818 3.622817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.816977e-10 2.980856e-10 2.674074e-10 ] [ 1.919186e-10 2.00454e-10 4.634036e-10 ] [ 9.862405e-11 4.087254e-10 4.422598e-10 ] [ 4.092598e-10 2.125916e-10 2.093906e-10 ] [ 4.150721e-10 2.426451e-10 4.257829e-10 ] [ 3.183229e-10 4.446818000000001e-10 3.622817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.0269702 -2.3047933 -18.3958758 ] [ -2.871645 -8.3265493 8.832379 ] [ -5.5052663 5.495628 5.1369684 ] [ 2.8977181 -2.4288855 -6.0614747 ] [ 10.829088 -2.9328841 8.7134794 ] [ 5.6770753 10.4974842 1.7745237 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76671538526983e-08 -3.692685941036481e-09 -2.94734421259005e-08 ] [ -4.600882482237217e-09 -1.334060262039861e-08 1.415103113984488e-08 ] [ -8.820408957138118e-09 8.804966698213862e-09 8.230330672268382e-09 ] [ 4.642656193488997e-09 -3.891503562700118e-09 -9.711553051910693e-09 ] [ 1.735011161818583e-08 -4.698998336536049e-09 1.396053298050241e-08 ] [ 9.095677320181146e-09 1.681882376245739e-08 2.843100385195513e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 10.127188 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.622554384804631e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7294135 2.7638162 2.0987317 ] [ 1.9812438 1.8648506 4.8846513 ] [ 0.9279915 4.2819952 4.5537581 ] [ 4.0012284 2.1634985 2.0768246 ] [ 4.3112119 2.1602274 4.3641358 ] [ 3.1978624 4.8374471 3.7271586 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7294135e-10 2.7638162e-10 2.0987317e-10 ] [ 1.9812438e-10 1.8648506e-10 4.8846513e-10 ] [ 9.279915e-11 4.2819952e-10 4.5537581e-10 ] [ 4.0012284e-10 2.1634985e-10 2.0768246e-10 ] [ 4.3112119e-10 2.1602274e-10 4.3641358e-10 ] [ 3.1978624e-10 4.8374471e-10 3.7271586e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.1040239 -1.6301662 -1.6848017 ] [ 2.4486094 -0.365762 0.5042051 ] [ 1.1009168 2.4910987 -0.0820402 ] [ -2.4755421 0.8301824 0.7401076 ] [ -1.3405494 -1.7691595 -0.6469286 ] [ -2.8374586 0.4438065 1.1694578 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.973194522984438e-09 -2.611814173658377e-09 -2.699349894424096e-09 ] [ 3.923104734151116e-09 -5.860153251770496e-10 8.07825623308126e-10 ] [ 1.76386315840595e-09 3.991180097245274e-09 -1.314428904057561e-10 ] [ -3.966255676426136e-09 1.330098832279634e-09 1.185783093596398e-09 ] [ -2.147796907707468e-09 -2.834505989366218e-09 -1.036493878246875e-09 ] [ -4.546109831407899e-09 7.110563984590752e-10 1.873677946172202e-09 ] ] } "relaxed-potential-energy" { "source-value" -13.693694 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.193971637918924e-18 } }