{ "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" [ [ 2.836172 2.264881 3.605889 ] [ 1.711544 3.356754 1.507539 ] [ 2.817956 4.908146 3.003841 ] [ 0.8092812 3.284881 3.852119 ] [ 4.796821 1.314646 2.655969 ] [ 4.297416 3.615744 1.848977 ] [ 4.570903 3.768738 4.135906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836172e-10 2.264881e-10 3.605889e-10 ] [ 1.711544e-10 3.356754e-10 1.507539e-10 ] [ 2.817956e-10 4.908146e-10 3.003841e-10 ] [ 8.092812000000001e-11 3.284881e-10 3.852119e-10 ] [ 4.796821e-10 1.314646e-10 2.655969e-10 ] [ 4.297416000000001e-10 3.615744e-10 1.848977e-10 ] [ 4.570903000000001e-10 3.768738e-10 4.135906000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2878277 -6.3032139 4.1534414 ] [ -1.2015037 -0.167641 -2.7144174 ] [ -0.6567877 6.2423413 0.0207576 ] [ -1.6981955 -0.273209 1.2524863 ] [ 0.5843291 -2.6344388 -1.2032817 ] [ 3.2575632 1.2107191 -4.4413422 ] [ 1.0024225 1.9254423 2.9323559 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.063327432558636e-09 -1.009886194648159e-08 6.654546706942821e-09 ] [ -1.925021137944697e-09 -2.685904908875329e-10 -4.348976097372722e-09 ] [ -1.052289897769004e-09 1.000133328991428e-08 3.325734142391808e-11 ] [ -2.720809127647766e-09 -4.377290723921472e-10 2.006704267732295e-09 ] [ 9.361984228731055e-10 -4.220836254288407e-09 -1.927869807976479e-09 ] [ 5.219191599818435e-09 1.939785836376017e-09 -7.115814637812438e-09 ] [ 1.606057893663888e-09 3.08489863775938e-09 4.698152066844943e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.325269 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.1349434457671e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1890776 2.0240472 4.313856 ] [ 2.0718496 4.0582171 1.7219338 ] [ 3.1589853 5.582949 3.1674783 ] [ 1.1367967 2.5068086 3.2423846 ] [ 4.5621786 1.379408 2.498563 ] [ 3.7882733 2.7885023 0.7031166 ] [ 3.932932 4.173858 4.9629077 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1890776e-10 2.0240472e-10 4.313856e-10 ] [ 2.0718496e-10 4.0582171e-10 1.7219338e-10 ] [ 3.1589853e-10 5.582949000000001e-10 3.1674783e-10 ] [ 1.1367967e-10 2.5068086e-10 3.2423846e-10 ] [ 4.5621786e-10 1.379408e-10 2.498563e-10 ] [ 3.7882733e-10 2.7885023e-10 7.031166e-11 ] [ 3.932932e-10 4.173858e-10 4.9629077e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.45e-05 -4.6e-06 3.07e-05 ] [ -6.3e-06 -3.4e-06 1.5e-06 ] [ 2.66e-05 -1.35e-05 -2.27e-05 ] [ 1.32e-05 -1.5e-06 8e-06 ] [ 5.9e-06 1.68e-05 -2.53e-05 ] [ -2.2e-06 8.1e-06 -4.2e-06 ] [ -2.26e-05 -1.8e-06 1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.32315610016e-14 -7.370012455680001e-15 4.918682225856e-14 ] [ -1.009371271104e-14 -5.44740051072e-15 2.4032649312e-15 ] [ 4.261789811328e-14 -2.16293843808e-14 -3.636940929216e-14 ] [ 2.114873139456e-14 -2.4032649312e-15 1.28174129664e-14 ] [ 9.45284206272e-15 2.691656722944e-14 -4.053506850624e-14 ] [ -3.52478856576e-15 1.297763062848e-14 -6.72914180736e-15 ] [ -3.620919163008e-14 -2.88391791744e-15 1.92261194496e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }