{ "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" [ [ 0.099853 0.7165901 0.5986145 ] [ 0.2043706 1.471965 2.579922 ] [ 1.736021 0.3195483 2.600696 ] [ 1.725047 2.389347 1.166635 ] [ 1.83697 2.73027 2.853175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.9853e-12 7.165901e-11 5.986145000000001e-11 ] [ 2.043706e-11 1.471965e-10 2.579922e-10 ] [ 1.736021e-10 3.195483e-11 2.600696e-10 ] [ 1.725047e-10 2.389347e-10 1.166635e-10 ] [ 1.83697e-10 2.73027e-10 2.853175e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6147042 -0.9448305 -3.3847136 ] [ -17.4579193 5.193576 5.1740651 ] [ 10.872004 -8.3979879 -0.2114743 ] [ -0.5580369 -6.2580573 -36.8728818 ] [ 6.5292479 10.4072998 35.2950046 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.848646979475673e-10 -1.513785337718775e-09 -5.422908998023803e-09 ] [ -2.79706701502731e-08 8.321026045547981e-09 8.289766137717214e-09 ] [ 1.741887063004408e-08 -1.345505987514129e-08 -3.388191793600455e-10 ] [ -8.940736747237074e-10 -1.002651309768677e-08 -5.907686916148182e-08 ] [ 1.04610083367875e-08 1.667433242521652e-08 5.654883120114845e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.7624487 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.823754102499353e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4621493 0.7489223 0.7479979 ] [ -0.2791294 1.5306523 2.9012564 ] [ 1.7230786 0.1380559 2.7060636 ] [ 1.7853465 2.6788516 0.5517715 ] [ 1.9108166 2.5312384 2.8919531 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.621493e-11 7.489223000000001e-11 7.479979e-11 ] [ -2.791294e-11 1.5306523e-10 2.9012564e-10 ] [ 1.7230786e-10 1.380559e-11 2.7060636e-10 ] [ 1.7853465e-10 2.6788516e-10 5.517715e-11 ] [ 1.9108166e-10 2.5312384e-10 2.8919531e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-05 1.07e-05 -9.5e-06 ] [ -5.1e-06 -1.7e-06 1.32e-05 ] [ -1.8e-06 -5.8e-06 8.8e-06 ] [ -2.6e-06 -2.2e-06 3.1e-06 ] [ -1.4e-06 -1e-06 -1.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.76239428288e-14 1.714328984256e-14 -1.52206778976e-14 ] [ -8.17110076608e-15 -2.72370025536e-15 2.114873139456e-14 ] [ -2.88391791744e-15 -9.292624400640001e-15 1.409915426304e-14 ] [ -4.16565921408e-15 -3.52478856576e-15 4.96674752448e-15 ] [ -2.24304726912e-15 -1.6021766208e-15 -2.499395528448e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.214602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.277430299837692e-18 } }