{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.924048 -0.399052 -0.3584118 ] [ 1.6039914 0.1684349 1.5553982 ] [ 0.7306295 -0.2563627 0.5817038 ] [ 1.7934923 0.831192 -0.5918819 ] [ -1.3258284 -1.5247846 -0.1260176 ] [ -1.3915105 -0.3887721 -0.7868115 ] [ 0.5132737 1.5693446 -0.2739793 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.082664748294431e-09 -6.39351790150968e-10 -5.742390113098811e-10 ] [ 2.569877542216947e-09 2.698624611301266e-10 2.492022652605658e-09 ] [ 1.170597513011103e-09 -4.107383277691517e-10 9.319922362690091e-10 ] [ 2.873491456318918e-09 1.331716400767728e-09 -9.482993502675244e-10 ] [ -2.124211283173605e-09 -2.442974258003037e-09 -2.019024541927584e-10 ] [ -2.229445609065657e-09 -6.228815745711114e-10 -1.260611000662491e-09 ] [ 8.223551289867257e-10 2.514367248814076e-09 -4.389632326596761e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.064748 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.054509377869823e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1094815 0.6866484 1.6169438 ] [ 2.1147831 0.9249909 2.2334405 ] [ 2.3737054 3.1723883 2.9516011 ] [ 2.0443739 0.1353002 4.5200614 ] [ 4.2491205 0.5603775 3.5614383 ] [ 3.0214352 2.2524783 5.1503217 ] [ 4.7000673 2.9353825 3.4854233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.094815e-11 6.866484e-11 1.6169438e-10 ] [ 2.1147831e-10 9.249909e-11 2.2334405e-10 ] [ 2.3737054e-10 3.1723883e-10 2.9516011e-10 ] [ 2.0443739e-10 1.353002e-11 4.5200614e-10 ] [ 4.2491205e-10 5.603775e-11 3.5614383e-10 ] [ 3.0214352e-10 2.2524783e-10 5.150321700000001e-10 ] [ 4.7000673e-10 2.9353825e-10 3.4854233e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.02e-05 4.9e-06 -2.3e-06 ] [ 2.7e-06 -7e-06 -1.02e-05 ] [ 6.3e-06 -2.37e-05 7.4e-06 ] [ 1.7e-06 1.38e-05 1.19e-05 ] [ -2.39e-05 2.22e-05 -8.3e-06 ] [ 9.5e-06 -9.2e-06 1.5e-06 ] [ -6.6e-06 -1e-06 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.63422016668e-14 7.850665506599998e-15 -3.685006258199999e-15 ] [ 4.3258769118e-15 -1.1215236438e-14 -1.63422016668e-14 ] [ 1.00937127942e-14 -3.79715862258e-14 1.18561070916e-14 ] [ 2.7237002778e-15 2.21100375492e-14 1.90659019446e-14 ] [ -3.82920215526e-14 3.55683212748e-14 -1.32980660622e-14 ] [ 1.5220678023e-14 -1.47400250328e-14 2.403264951e-15 ] [ -1.05743657844e-14 -1.602176634e-15 0.0 ] ] } "relaxed-potential-energy" { "source-value" -19.968082 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.199239440619598e-18 } }