{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.1944966 1.8319859 -4.2145372 ] [ 6.5326156 -6.5563154 2.8545165 ] [ -0.8189618 5.7944471 -3.1811984 ] [ 2.1158937 3.6185265 7.3828292 ] [ -5.4081053 -6.2618598 3.5210615 ] [ -5.3150949 5.4798285 0.3230019 ] [ -3.3008439 -3.9066128 -6.6856735 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.92467763014509e-09 2.935164978615247e-09 -6.752432969331894e-09 ] [ 1.046640398699336e-08 -1.0504375252471e-08 4.573439599987842e-09 ] [ -1.312121449288285e-09 9.28372767408236e-09 -5.096841702606367e-09 ] [ 3.390035418238009e-09 5.797518560045252e-09 1.182859633959957e-08 ] [ -8.66473987448457e-09 -1.003260537428736e-08 5.641362415698979e-09 ] [ -8.515720786113314e-09 8.779653108693534e-09 5.175060926539796e-10 ] [ -5.288534925490294e-09 -6.259083694678026e-09 -1.071162977600211e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -35.084133 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.621097765363777e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3701787 2.193448 4.2657626 ] [ 2.7195433 3.7987767 2.7731736 ] [ 5.0460902 1.0453876 2.1334375 ] [ 4.4319704 2.6313842 3.5388007 ] [ 2.9315422 1.6796194 2.1919276 ] [ 3.7929996 0.5466622 3.895241 ] [ 3.3964038 4.0529489 4.8708349 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3701787e-10 2.193448e-10 4.265762600000001e-10 ] [ 2.7195433e-10 3.7987767e-10 2.7731736e-10 ] [ 5.046090200000001e-10 1.0453876e-10 2.1334375e-10 ] [ 4.4319704e-10 2.6313842e-10 3.5388007e-10 ] [ 2.9315422e-10 1.6796194e-10 2.1919276e-10 ] [ 3.7929996e-10 5.466622e-11 3.895241e-10 ] [ 3.3964038e-10 4.0529489e-10 4.870834900000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0001647 3.7e-05 9.7e-06 ] [ 2.13e-05 2.42e-05 2.05e-05 ] [ 7.2e-05 3.65e-05 4.01e-05 ] [ 6e-07 -0.000113 5.25e-05 ] [ -0.0001365 -3.87e-05 1.12e-05 ] [ -3.69e-05 4.33e-05 -8.1e-05 ] [ -8.53e-05 1.08e-05 -5.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.6387848944576e-13 5.92805349696e-14 1.554111322176e-14 ] [ 3.412636202304e-14 3.877267422336e-14 3.28446207264e-14 ] [ 1.153567166976e-13 5.84794466592e-14 6.424728249408e-14 ] [ 9.6130597248e-16 -1.810459581504e-13 8.4114272592e-14 ] [ -2.186971087392e-13 -6.200423522496e-14 1.794437815296e-14 ] [ -5.912031730752001e-14 6.937424768064e-14 -1.297763062848e-13 ] [ -1.3666566575424e-13 1.730350750464e-14 -8.49153609024e-14 ] ] } "relaxed-potential-energy" { "source-value" -49.241665 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.889384443226563e-18 } }