{ "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" [ [ 2.690681 1.842727 3.696963 ] [ 2.658202 3.646198 2.018485 ] [ 5.329976 0.2810446 1.792372 ] [ 5.111587 2.700534 2.069297 ] [ 3.393505 1.493232 0.8693091 ] [ 5.014849 1.504764 3.993476 ] [ 3.843884 3.656776 4.040771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.690681e-10 1.842727e-10 3.696963e-10 ] [ 2.658202e-10 3.646198e-10 2.018485e-10 ] [ 5.329976000000001e-10 2.810446e-11 1.792372e-10 ] [ 5.111587e-10 2.700534e-10 2.069297e-10 ] [ 3.393505e-10 1.493232e-10 8.693091e-11 ] [ 5.014849e-10 1.504764e-10 3.993476e-10 ] [ 3.843884e-10 3.656776e-10 4.040771000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3378771 -1.778063 0.167477 ] [ 0.0236964 -0.8649116 -0.6283287 ] [ -0.6240986 0.7966759 0.7599187 ] [ 1.6058272 1.4445602 -1.4189303 ] [ -0.2322043 0.3287663 0.6923848 ] [ 0.2731619 -1.0389515 0.1248456 ] [ 1.2914946 1.1119237 0.3026328 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.745692062783681e-09 -2.848770992379942e-09 2.683277361324179e-10 ] [ 3.796581838991759e-11 -1.385741155995554e-09 -1.006693561611596e-09 ] [ -9.999161942321122e-10 1.276415511850921e-09 1.217523984879656e-09 ] [ 2.572818818081645e-09 2.314440598846367e-09 -2.27337697193461e-09 ] [ -3.720323037743261e-10 5.267416839066342e-10 1.109322748296763e-09 ] [ 4.376536134790446e-10 -1.664583817159251e-09 2.000247031777104e-10 ] [ 2.069202471057176e-09 1.781498170930826e-09 4.848712008419952e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.141595005765545 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.906603962172865e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3175739 1.4135517 3.413448 ] [ 2.9804881 3.3352127 2.1303125 ] [ 5.246708 1.0363124 1.9976888 ] [ 5.3440228 3.3094362 1.6924792 ] [ 3.1038207 1.1306521 1.1798675 ] [ 4.492303 1.3077657 4.1408161 ] [ 4.5577676 3.5923447 3.9260609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3175739e-10 1.4135517e-10 3.413448e-10 ] [ 2.9804881e-10 3.3352127e-10 2.1303125e-10 ] [ 5.246708000000001e-10 1.0363124e-10 1.9976888e-10 ] [ 5.344022800000001e-10 3.3094362e-10 1.6924792e-10 ] [ 3.1038207e-10 1.1306521e-10 1.1798675e-10 ] [ 4.492303e-10 1.3077657e-10 4.140816100000001e-10 ] [ 4.5577676e-10 3.5923447e-10 3.9260609e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.3e-06 2.84e-05 -4.2e-06 ] [ -1.32e-05 -6.1e-06 -5.3e-06 ] [ 2.91e-05 1.13e-05 -1.42e-05 ] [ -2.72e-05 -1.92e-05 1.79e-05 ] [ -4.8e-06 3.7e-06 -1.36e-05 ] [ 2.4e-06 -3.2e-06 3e-05 ] [ 9.4e-06 -1.48e-05 -1.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.8893595262e-15 4.550181640559999e-14 -6.729141862799999e-15 ] [ -2.11487315688e-14 -9.773277467399999e-15 -8.4915361602e-15 ] [ 4.66233400494e-14 1.81045959642e-14 -2.27509082028e-14 ] [ -4.35792044448e-14 -3.076179137279999e-14 2.86789617486e-14 ] [ -7.690447843199998e-15 5.9280535458e-15 -2.17896022224e-14 ] [ 3.845223921599999e-15 -5.1269652288e-15 4.806529901999999e-14 ] [ 1.50604603596e-14 -2.37122141832e-14 -1.69830723204e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.808943005765546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333960226207528e-18 } }