{ "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" [ [ -2.4719546 -1.5263958 1.6981385 ] [ -0.01953 -0.1902578 -0.1313456 ] [ -1.8561262 -1.0590893 1.0836547 ] [ 1.2569033 0.1643504 -0.2199649 ] [ 0.547712 0.2003023 1.3829988 ] [ 0.137929 0.2628995 -1.43119 ] [ 1.4601814 1.2360598 0.1960741 ] [ 0.9448851 0.9121308 -2.5783656 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.960507900428816e-09 -2.445555684995737e-09 2.720717825995809e-09 ] [ -3.129050966201999e-11 -3.048266015962451e-10 -2.104388512987104e-10 ] [ -2.973842027395211e-09 -1.696848129779416e-09 1.73620623966428e-09 ] [ 2.013781098457492e-09 2.633183706685536e-10 -3.524226230801466e-10 ] [ 8.775313685614079e-10 3.209196647964582e-10 2.215808362210039e-09 ] [ 2.20986620950986e-10 4.21211435990283e-10 -2.29301917681446e-09 ] [ 2.339468520481407e-09 1.980386129786713e-09 3.141453415525794e-10 ] [ 1.513872829034753e-09 1.461394654911727e-09 -4.13099711822939e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.4061616015624807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.507426276514244e-20 } }