{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.29616 0 0 ] "si-unit" "m" "si-value" [ 5.29616e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.242438 5.47618 0 ] "si-unit" "m" "si-value" [ -2.42438e-11 5.47618e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.11809 -0.0034447 5.45685 ] "si-unit" "m" "si-value" [ 1.1809e-11 -3.4447e-13 5.456850000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0183909 -0.0832388 -0.0590634 ] [ 1.37993 1.35458 1.33752 ] [ -0.123201 2.75975 2.68859 ] [ 1.45379 4.06883 4.12913 ] [ 2.80695 0.0674874 2.75473 ] [ 4.11558 1.36445 4.01895 ] [ 2.83757 2.84317 -0.0421665 ] [ 3.94058 4.22423 1.31424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.83909e-12 -8.32388e-12 -5.90634e-12 ] [ 1.37993e-10 1.35458e-10 1.33752e-10 ] [ -1.23201e-11 2.75975e-10 2.68859e-10 ] [ 1.45379e-10 4.06883e-10 4.12913e-10 ] [ 2.80695e-10 6.748740000000001e-12 2.75473e-10 ] [ 4.11558e-10 1.36445e-10 4.01895e-10 ] [ 2.83757e-10 2.84317e-10 -4.21665e-12 ] [ 3.94058e-10 4.224230000000001e-10 1.31424e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.1469905 1.7961855 -0.908533 ] [ -0.0520627 0.6466679 -0.1775776 ] [ 2.6510339 0.5993291 -0.5999889 ] [ -1.4848299 -0.0200053 -0.4998502 ] [ -0.3038843 -0.4798214 -1.139041 ] [ -0.1106784 -0.2040652 1.3591647 ] [ -1.9918917 -1.4490709 0.1604978 ] [ -0.8546774 -0.8892197 1.8053282 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.439857984179702e-09 2.877806414719958e-09 -1.455630331825286e-09 ] [ -8.341364075572417e-11 1.036076190801832e-09 -2.845106790977741e-10 ] [ 4.247424535528245e-09 9.602310721851052e-10 -9.612881883195093e-10 ] [ -2.378959751644802e-09 -3.205202395209024e-11 -8.008483043422042e-10 ] [ -4.868763208881734e-10 -7.687586292395251e-10 -1.824944860332653e-09 ] [ -1.773263449075507e-10 -3.269484925588762e-10 2.177621906156646e-09 ] [ -3.191362312905568e-09 -2.321667517861614e-09 2.571458228498343e-10 ] [ -1.36934414860613e-09 -1.42468701409479e-09 2.892454634910947e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.964124 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.320128907315219e-18 } }