{ "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" [ [ 2.5106773 2.0628841 -1.4707756 ] [ -0.0890721 0.6617167 -0.2501551 ] [ 2.5208865 0.8452831 -0.8917095 ] [ -1.4550454 -0.2711941 -0.4234419 ] [ -0.7220546 -0.4176328 -1.2580655 ] [ 0.003902499999999996 -0.2999564 1.6117395 ] [ -1.7528537 -1.6704554 0.1355117 ] [ -1.0164405 -0.9106452 2.5468965 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.022548505574207e-09 3.30510470367012e-09 -2.35644230017733e-09 ] [ -1.427092373613114e-10 1.060187035067588e-09 -4.007926560959334e-10 ] [ 4.038905447266041e-09 1.354292831935085e-09 -1.428676125215823e-09 ] [ -2.331239741289183e-09 -4.345008502986593e-10 -6.784287180365645e-10 ] [ -1.156859008592216e-09 -6.691215137519952e-10 -2.015643148141527e-09 ] [ 6.252494314184992e-12 -4.805831352987576e-10 2.582291366994843e-09 ] [ -2.808381240960446e-09 -2.676364610019124e-09 2.171136793736178e-10 ] [ -1.628517218951277e-09 -1.459014461304257e-09 4.08057806151638e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.658305074190157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.11091368579111e-18 } }