{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2910865 -1.0663145 -3.9559643 ] [ -2.7318395 0.5938384 -0.0921408 ] [ -1.9650053 1.2349538 2.058158 ] [ 0.7511775 -1.2823289 -1.0615856 ] [ 2.0687672 -1.4602517 0.8099014 ] [ 3.0502175 1.1560027 2.2195388 ] [ 0.1177692 0.8241001 0.0220925 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.068548622772841e-09 -1.708424176395393e-09 -6.338153566398165e-09 ] [ -4.376889414738243e-09 9.514340088519454e-10 -1.476258367980672e-10 ] [ -3.14828557734616e-09 1.978614122429509e-09 3.297532656680172e-09 ] [ 1.203519038486535e-09 -2.054517400682922e-09 -1.70084764331087e-09 ] [ 3.314530469025604e-09 -2.339581153498777e-09 1.297605098923887e-09 ] [ 4.886987207117894e-09 1.852120514780911e-09 3.556093203616399e-09 ] [ 1.886870604448728e-10 1.320353924297063e-09 3.5396087286645e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -14.265998 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.285664865629073e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5810466 3.2702008 0.8371181 ] [ 1.132042 1.6257913 3.9794996 ] [ 1.6128676 3.6744533 2.9377489 ] [ 4.6597458 2.3199705 1.2984311 ] [ 3.2107477 0.6756008 4.4408561 ] [ 4.7833041 2.2252091 3.6413355 ] [ 3.5888711 4.2131643 4.1308337 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5810466e-10 3.2702008e-10 8.371181e-11 ] [ 1.132042e-10 1.6257913e-10 3.9794996e-10 ] [ 1.6128676e-10 3.6744533e-10 2.9377489e-10 ] [ 4.6597458e-10 2.3199705e-10 1.2984311e-10 ] [ 3.2107477e-10 6.756008e-11 4.440856100000001e-10 ] [ 4.7833041e-10 2.2252091e-10 3.6413355e-10 ] [ 3.5888711e-10 4.2131643e-10 4.130833700000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.97e-05 -1.42e-05 -1.5e-06 ] [ -1.64e-05 2.23e-05 2.34e-05 ] [ -2.9e-06 -2.91e-05 5.9e-06 ] [ -4.8e-06 1.93e-05 3.2e-06 ] [ 7.3e-06 1.53e-05 -3.39e-05 ] [ 2.2e-06 -2.33e-05 6.1e-06 ] [ -5.2e-06 9.7e-06 -3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.15628796898e-14 -2.27509082028e-14 -2.403264951e-15 ] [ -2.62756967976e-14 3.572853893819999e-14 3.749093323559999e-14 ] [ -4.6463122386e-15 -4.66233400494e-14 9.452842140600001e-15 ] [ -7.690447843199998e-15 3.09220090362e-14 5.1269652288e-15 ] [ 1.16958894282e-14 2.45133025002e-14 -5.431378789259999e-14 ] [ 3.5247885948e-15 -3.733071557219999e-14 9.773277467399999e-15 ] [ -8.331318496799998e-15 1.55411133498e-14 -5.1269652288e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.649165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.987925640661061e-18 } }