{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2519361 0.630526 0.2961672 ] [ 1.040527 1.338339 0.9480581 ] [ 1.471162 2.964903 0.310665 ] [ 0.0960364 2.590998 1.829013 ] [ 2.039261 0.0625187 0.2196196 ] [ 2.19391 1.549757 2.906446 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.519361e-11 6.30526e-11 2.961672e-11 ] [ 1.040527e-10 1.338339e-10 9.480581e-11 ] [ 1.471162e-10 2.964903e-10 3.10665e-11 ] [ 9.60364e-12 2.590998e-10 1.829013e-10 ] [ 2.039261e-10 6.25187e-12 2.196196e-11 ] [ 2.19391e-10 1.549757e-10 2.906446e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -89.7957564 -68.4948404 -62.8539605 ] [ 74.2010281 58.7209022 64.2490499 ] [ 7.318929 14.0937017 -9.4826359 ] [ -12.5817562 12.1028805 14.3224999 ] [ 21.559915 -15.1090273 -6.1023775 ] [ -0.7023594 -1.3136167 -0.132576 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.43868661551132e-07 -1.097408319343073e-07 -1.007031460377867e-07 ] [ 1.188831524611438e-07 9.408125665712329e-08 1.029383256583926e-07 ] [ 1.172621693309512e-08 2.258059936426922e-08 -1.519285754253877e-08 ] [ -2.015819563224545e-08 1.939095218143621e-08 2.294717449119034e-08 ] [ 3.454279175943523e-08 -2.420733030308895e-08 -9.777086561795954e-09 ] [ -1.125303810079116e-09 -2.104645965432447e-09 -2.124101676791808e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 29.974313 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.802414351314151e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0928819 1.0013473 -0.0170635 ] [ 2.2321093 1.5617004 1.0594751 ] [ 0.9362784 3.2674916 -0.0499182 ] [ 0.0933554 2.3192174 2.0087367 ] [ 1.8687246 -0.5862882 0.094302 ] [ 1.8694829 1.5735732 3.4144369 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.288190000000001e-12 1.0013473e-10 -1.70635e-12 ] [ 2.2321093e-10 1.5617004e-10 1.0594751e-10 ] [ 9.362784e-11 3.2674916e-10 -4.991820000000001e-12 ] [ 9.335540000000001e-12 2.3192174e-10 2.0087367e-10 ] [ 1.8687246e-10 -5.862882000000001e-11 9.4302e-12 ] [ 1.8694829e-10 1.5735732e-10 3.4144369e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.16e-05 -7.4e-06 1.82e-05 ] [ -3.15e-05 -1.32e-05 1.89e-05 ] [ 2.34e-05 -6e-07 3.4e-06 ] [ -1.65e-05 -1.49e-05 2.79e-05 ] [ -1.45e-05 5.3e-06 -2.12e-05 ] [ -2.5e-06 3.07e-05 -4.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.665054742528e-14 -1.185610699392e-14 2.915961449856e-14 ] [ -5.04685635552e-14 -2.114873139456e-14 3.028113813312e-14 ] [ 3.749093292672001e-14 -9.6130597248e-16 5.44740051072e-15 ] [ -2.64359142432e-14 -2.387243164992e-14 4.470072772032e-14 ] [ -2.32315610016e-14 8.491536090240001e-15 -3.396614436096001e-14 ] [ -4.005441552e-15 4.918682225856e-14 -7.562273650176e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.77256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.328130998616525e-18 } }