{ "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" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.601188 -4.1786116 -4.2842255 ] [ -12.3854117 7.5873759 -3.1834656 ] [ -7.7315125 -7.0962989 8.0866579 ] [ 0.6369617 -0.3304049 -0.9072241 ] [ 7.7357 -3.5427184 -1.4143394 ] [ 6.997549 1.1351187 -5.1721015 ] [ 4.1455256 6.4255392 6.8746983 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.632093583055102e-10 -6.694873812923681e-09 -6.86408593433519e-09 ] [ -1.984361706472279e-08 1.215631628020136e-08 -5.100474157441045e-09 ] [ -1.238724857092296e-08 -1.136952419178876e-08 1.295625422778763e-08 ] [ 1.020525144085023e-09 -5.293670061777619e-10 -1.453533242846321e-09 ] [ 1.239395768552256e-08 -5.676060594557982e-09 -2.266021520556299e-09 ] [ 1.121130941070242e-08 1.818660642972889e-09 -8.286620103704612e-09 ] [ 6.641864197247893e-09 1.029484868227394e-08 1.10144808913135e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.8579371 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.783273246936952e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8444482 2.21839 1.4718216 ] [ 2.0142128 5.3531515 1.5903558 ] [ 1.7402357 2.6766703 3.3433428 ] [ 4.6651563 3.4092633 0.4927278 ] [ 4.8122074 3.2025199 3.6576097 ] [ 3.9104342 5.3194884 0.6940176 ] [ 3.9148743 4.9082955 3.9704889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8444482e-10 2.21839e-10 1.4718216e-10 ] [ 2.0142128e-10 5.353151500000001e-10 1.5903558e-10 ] [ 1.7402357e-10 2.6766703e-10 3.3433428e-10 ] [ 4.665156299999999e-10 3.4092633e-10 4.927278e-11 ] [ 4.8122074e-10 3.2025199e-10 3.6576097e-10 ] [ 3.9104342e-10 5.3194884e-10 6.940176000000001e-11 ] [ 3.9148743e-10 4.9082955e-10 3.9704889e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.9540066 -1.1891973 0.0149556 ] [ 1.4566403 -0.2772562 -0.7859832 ] [ -0.0896796 -0.5659675 -0.2128511 ] [ -1.5929932 1.1625162 0.7415306 ] [ 0.5557503 -0.144547 1.1450815 ] [ 0.2517975 1.0324155 -1.0079044 ] [ 0.3724913 -0.0179637 0.1051709 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.528487070608898e-09 -1.905304111578484e-09 2.396151267003648e-11 ] [ 2.333795033575099e-09 -4.44213401611849e-10 -1.259283907381571e-09 ] [ -1.436825584826957e-10 -9.067798966326239e-10 -3.410250561315629e-10 ] [ -2.552256462133379e-09 1.862556276941257e-09 1.188062990927797e-09 ] [ 8.904101376625864e-10 -2.315898240067776e-10 1.834622808210595e-09 ] [ 4.03424067675888e-10 1.654111977051542e-09 -1.614840865681451e-09 ] [ 5.967968523113991e-10 -2.878102016306496e-11 1.685023571684947e-10 ] ] } "relaxed-potential-energy" { "source-value" -26.459902 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.239343637305917e-18 } }