{ "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" [ [ 4.205833 3.4082215 -1.0972249 ] [ -0.147891 1.1192155 -0.2378698 ] [ 4.7507224 0.6641469 -0.9076912 ] [ -2.4883139 0.121806 -0.9452452 ] [ -0.5594312 -0.7454117 -1.7767505 ] [ -0.3213958 -0.1164727 1.9894393 ] [ -4.0738541 -2.8550181 0.3413199 ] [ -1.3656693 -1.5964873 2.6340224 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.738487303589126e-09 5.460572805807907e-09 -1.757948082539618e-09 ] [ -2.369475026267328e-10 1.793180907736982e-09 -3.811094323543718e-10 ] [ 7.611496361190865e-09 1.064080635956796e-09 -1.454281619545897e-09 ] [ -3.986718355791669e-09 1.951547254731648e-10 -1.51444976036342e-09 ] [ -8.963075895860891e-10 -1.194281198610784e-09 -2.84666811209471e-09 ] [ -5.149328367833127e-10 -1.866098369014522e-10 3.187433134960717e-09 ] [ -6.527033795570226e-09 -4.574243251780837e-09 5.46854763993794e-10 ] [ -2.188043424204302e-09 -2.557854627464116e-09 4.220169107943506e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.168124 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.634554607019538e-18 } }