{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.4533355e-10 1.8559839e-10 -8.519136e-11 ] [ -2.2370431e-10 2.5772442e-10 1.9283965e-10 ] [ 1.1999678e-10 5.6764135e-10 4.959289499999999e-10 ] [ 7.2192981e-10 1.0613321e-10 1.7756557e-10 ] [ 3.2037468e-10 5.961144e-11 5.6115403e-10 ] [ 4.5151066e-10 6.7506376e-10 6.646341999999999e-11 ] [ 6.6621095e-10 5.107927400000001e-10 5.4586715e-10 ] ] "source-value" [ [ 2.4533355 1.8559839 -0.8519136 ] [ -2.2370431 2.5772442 1.9283965 ] [ 1.1999678 5.6764135 4.9592895 ] [ 7.2192981 1.0613321 1.7756557 ] [ 3.2037468 0.5961144 5.6115403 ] [ 4.5151066 6.7506376 0.6646342 ] [ 6.6621095 5.1079274 5.4586715 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 0.0 -4.8065298624e-16 ] [ -4.8065298624e-16 0.0 3.2043532416e-16 ] [ 0.0 0.0 0.0 ] [ 4.8065298624e-16 -1.6021766208e-16 1.6021766208e-16 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 1.6021766208e-16 1.6021766208e-16 ] ] "source-value" [ [ -0.0 0.0 -3e-07 ] [ -3e-07 0.0 2e-07 ] [ -0.0 0.0 -0.0 ] [ 3e-07 -1e-07 1e-07 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 1e-07 1e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.155214624689005e-32 "source-value" 2.593481e-13 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -9.48265488462686e-09 -8.621560093030376e-09 -1.884351999298828e-08 ] [ -1.333501198529799e-08 -2.024214456021018e-09 -2.490088003804786e-09 ] [ -1.820615026080239e-08 1.398418046655477e-08 1.30146670238994e-08 ] [ 2.090287835340421e-08 -2.016608907580314e-08 -1.330417649405407e-08 ] [ -4.984741249672881e-09 -2.118879462205142e-08 2.112369177724182e-08 ] [ 4.14693457591271e-09 2.424681802873817e-08 -1.715155595239969e-08 ] [ 2.095874561130086e-08 1.376965991183067e-08 1.765098180232327e-08 ] ] "source-value" [ [ -5.9186077 -5.3811546 -11.7612002 ] [ -8.3230599 -1.2634153 -1.5541907 ] [ -11.3633853 8.728239 8.1231163 ] [ 13.0465506 -12.5866829 -8.3038139 ] [ -3.1112308 -13.2250055 13.1843715 ] [ 2.588313 15.1336736 -10.7051593 ] [ 13.0814202 8.5943458 11.0168764 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.203849237172539e-17 "source-value" 75.13836 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] "source-value" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] } "instance-id" 1 }