{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.596743 -19.2115144 -9.9425298 ] [ -32.2503783 3.6112342 27.7601647 ] [ 8.8770681 11.8982619 -41.0903665 ] [ 27.0697749 -21.1271528 16.0954097 ] [ 9.9002783 24.8291711 7.1773219 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.178438375362605e-08 -3.078023922184254e-08 -1.59296887971673e-08 ] [ -5.167080212421565e-08 5.785835007473392e-09 4.447668687189744e-08 ] [ 1.422263097106948e-08 1.906311704433539e-08 -6.583402454640352e-08 ] [ 4.337056047509865e-08 -3.384943028022926e-08 2.578768912353754e-08 ] [ 1.586199443167357e-08 3.978071745026302e-08 1.149933734813584e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 27.152979 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.350386813887337e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7197142 0.7197926 0.9315576 ] [ 1.8410387 2.5364763 2.560604 ] [ 3.6036359 2.7885879 -0.3587846 ] [ 4.9088553 1.0518649 2.2819378 ] [ 4.1826579 3.5314836 2.0576257 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7197142e-10 7.197926e-11 9.315576e-11 ] [ 1.8410387e-10 2.5364763e-10 2.560604e-10 ] [ 3.6036359e-10 2.7885879e-10 -3.587846e-11 ] [ 4.9088553e-10 1.0518649e-10 2.2819378e-10 ] [ 4.1826579e-10 3.5314836e-10 2.0576257e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.26e-05 -5.18e-05 -4.06e-05 ] [ 1.88e-05 -1.44e-05 1.42e-05 ] [ 1.86e-05 -1.82e-05 5.7e-06 ] [ -8.3e-06 2.19e-05 -1.6e-06 ] [ 2.35e-05 6.24e-05 2.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.427449025408001e-14 -8.299274895744e-14 -6.504837080448e-14 ] [ 3.012092047104e-14 -2.307134333952e-14 2.275090801536e-14 ] [ 2.980048514688e-14 -2.915961449856e-14 9.13240673856e-15 ] [ -1.329806595264e-14 3.508766799552e-14 -2.56348259328e-15 ] [ 3.76511505888e-14 9.997582113791999e-14 3.588875630592e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.8977283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.425573226049053e-18 } }