{ "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" [ [ 0.1126891 1.464287 0.6414025 ] [ 1.365449 0.1265984 2.502806 ] [ 0.3364486 2.37729 2.80341 ] [ 2.851665 1.424041 0.0715282 ] [ 2.597469 0.5436052 1.609588 ] [ 2.328633 2.330176 2.375244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.126891e-11 1.464287e-10 6.414025e-11 ] [ 1.365449e-10 1.265984e-11 2.502806e-10 ] [ 3.364486e-11 2.37729e-10 2.80341e-10 ] [ 2.851665e-10 1.424041e-10 7.15282e-12 ] [ 2.597469e-10 5.436052e-11 1.609588e-10 ] [ 2.328633e-10 2.330176e-10 2.375244e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.7774861 0.6982592 -4.1134271 ] [ -42.2214054 -13.7902902 28.0672208 ] [ -5.702146 -1.3530375 2.3289954 ] [ 3.4036801 9.9963898 -20.08556 ] [ 44.5265207 -10.3753183 -11.9460934 ] [ 7.7708366 14.823997 5.7488642 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.246090650067979e-08 1.118734574715533e-09 -6.590436785282381e-09 ] [ -6.764614918652143e-08 -2.209448073451919e-08 4.496864534707878e-08 ] [ -9.135845084856563e-09 -2.167805067425775e-09 3.731462010573483e-09 ] [ 5.453296725830783e-09 1.601598216191593e-08 -3.218061491280504e-08 ] [ 7.133935105885732e-08 -1.66230925505726e-08 -1.913975171306162e-08 ] [ 1.2450252827152e-08 2.37506616158861e-08 9.210695893279102e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 9.3325471 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.495238889932446e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0953513 1.317177 0.4961112 ] [ 0.7768988 -0.1489824 2.4607257 ] [ 0.4107607 2.3456941 2.8018683 ] [ 2.4374641 1.7299087 -0.0083676 ] [ 3.1190098 0.2637607 1.956256 ] [ 2.7528689 2.7584394 2.2973851 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.53513e-12 1.317177e-10 4.961112e-11 ] [ 7.768988e-11 -1.489824e-11 2.4607257e-10 ] [ 4.107607e-11 2.3456941e-10 2.8018683e-10 ] [ 2.4374641e-10 1.7299087e-10 -8.3676e-13 ] [ 3.119009800000001e-10 2.637607e-11 1.956256e-10 ] [ 2.7528689e-10 2.7584394e-10 2.2973851e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.06e-05 -2.3e-06 -1.08e-05 ] [ -1.52e-05 -1.13e-05 2.01e-05 ] [ -2.23e-05 8.5e-06 6.8e-06 ] [ 9.7e-06 1.33e-05 -1.26e-05 ] [ 2.3e-05 -8.5e-06 -4.7e-06 ] [ 1.54e-05 4e-07 1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.69830723204e-14 -3.685006258199999e-15 -1.73035076472e-14 ] [ -2.43530848368e-14 -1.81045959642e-14 3.22037503434e-14 ] [ -3.572853893819999e-14 1.3618501389e-14 1.08948011112e-14 ] [ 1.55411133498e-14 2.13089492322e-14 -2.01874255884e-14 ] [ 3.6850062582e-14 -1.3618501389e-14 -7.530230179799999e-15 ] [ 2.46735201636e-14 6.408706536e-16 1.7623942974e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.331035 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.296084941803619e-18 } }