{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9792832 -0.3576929 -0.3199951 ] [ -1.2234899 -0.4020582 1.2572205 ] [ -1.7892849 0.382628 -1.0206968 ] [ 0.2099313 1.0719055 -0.1035111 ] [ 0.511759 -0.6157745 -1.9388148 ] [ 1.8293022 -0.7394535 1.9038631 ] [ 1.4410655 0.6604455 0.2219342 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.568984661108749e-09 -5.730872065276985e-10 -5.126886722144933e-10 ] [ -1.960246929714996e-09 -6.441682535480987e-10 2.014289308885797e-09 ] [ -2.866750458349026e-09 6.13037641114152e-10 -1.635336563358571e-09 ] [ 3.363470236052442e-10 1.717381945956087e-09 -1.658430657796374e-10 ] [ 8.199283120392059e-10 -9.86579515713033e-10 -3.106323770213383e-09 ] [ 2.930865241364794e-09 -1.184735119629519e-09 3.050324973154805e-09 ] [ 2.308841472163527e-09 1.058150348130447e-09 3.555777895254827e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.405833 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.429592546390612e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7431805 1.6681046 2.5854233 ] [ 2.3569713 2.2302422 4.7928926 ] [ 2.1281718 3.8624571 1.9277401 ] [ 2.7381846 4.420931 4.1209618 ] [ 3.9836011 1.3789942 2.0442404 ] [ 4.593449 1.9376768 4.2374597 ] [ 4.4664947 3.7020361 2.5707391 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7431805e-10 1.6681046e-10 2.5854233e-10 ] [ 2.3569713e-10 2.2302422e-10 4.7928926e-10 ] [ 2.1281718e-10 3.8624571e-10 1.9277401e-10 ] [ 2.7381846e-10 4.420931000000001e-10 4.1209618e-10 ] [ 3.9836011e-10 1.3789942e-10 2.0442404e-10 ] [ 4.593449e-10 1.9376768e-10 4.2374597e-10 ] [ 4.4664947e-10 3.7020361e-10 2.5707391e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.5e-05 -2.5e-06 3e-05 ] [ 9.3e-06 -5.8e-06 -8.9e-06 ] [ 5.1e-06 1.36e-05 -2.53e-05 ] [ -2.4e-06 -1.65e-05 5e-07 ] [ 9.5e-06 4e-07 1.03e-05 ] [ -1.17e-05 -7.5e-06 -8.8e-06 ] [ 5.2e-06 1.82e-05 2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.403264951e-14 -4.005441585e-15 4.806529901999999e-14 ] [ 1.49002426962e-14 -9.2926244772e-15 -1.42593720426e-14 ] [ 8.1711008334e-15 2.17896022224e-14 -4.053506884019999e-14 ] [ -3.845223921599999e-15 -2.6435914461e-14 8.010883169999999e-16 ] [ 1.5220678023e-14 6.408706536e-16 1.65024193302e-14 ] [ -1.87454666178e-14 -1.2016324755e-14 -1.40991543792e-14 ] [ 8.331318496799998e-15 2.915961473879999e-14 3.5247885948e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993289292598e-18 } }