{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -18.8410372 -23.7945161 8.9551033 ] [ -16.6780953 16.5635983 9.3975451 ] [ 3.2643951 9.1336009 -13.00946 ] [ 15.5938694 -2.0953996 18.0032056 ] [ 16.660868 0.1927165 -23.346394 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.018666931346309e-08 -3.812301739866919e-08 1.434765714410893e-08 ] [ -2.672125436913436e-08 2.653780995258262e-08 1.50565270521336e-08 ] [ 5.230137510274079e-09 1.463364182569784e-08 -2.084345266123277e-08 ] [ 2.498413298048853e-08 -3.357200250353672e-09 2.884431511177564e-08 ] [ 2.669365319183486e-08 3.087658707424032e-10 -3.74050466467854e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 234.25737 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.753216814640953e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.3073684 -0.6226163 1.8122199 ] [ -0.3426372 3.1756383 2.2005086 ] [ 2.399392 1.3489566 -0.1295493 ] [ 2.8284737 0.9319922 2.6162342 ] [ 2.399392 1.3489566 -0.1295493 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.073684e-11 -6.226163e-11 1.8122199e-10 ] [ -3.426372e-11 3.1756383e-10 2.2005086e-10 ] [ 2.399392e-10 1.3489566e-10 -1.295493e-11 ] [ 2.8284737e-10 9.319922000000001e-11 2.6162342e-10 ] [ 2.399392e-10 1.3489566e-10 -1.295493e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.0439694 -10.8670234 2.913218 ] [ -7.4568295 7.9961773 3.5657055 ] [ 3.5832169 2.007371 -2.9634341202850008e+119 ] [ 9.3343651 -1.1438959 15.3019566 ] [ 3.5832169 2.007371 2.9634341202850008e+119 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.44900363319106e-08 -1.741089082916653e-08 4.667489770893735e-09 ] [ -1.194715789019176e-08 1.281128832583167e-08 5.712889988757975e-09 ] [ 5.740946344435452e-09 3.216162885471917e-09 -4.747944864801643e+110 ] [ 1.495530153323145e-08 -1.832723267608975e-09 2.451643711701626e-08 ] [ 5.740946344435452e-09 3.216162885471917e-09 4.747944864801643e+110 ] ] } "relaxed-potential-energy" { "source-value" -1.3708637e+102 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.196365770443385e+83 } }