{ "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" [ [ 2.1279059 1.7984317 -1.2349739 ] [ -0.170499 0.5477481 -0.0849068 ] [ 2.2403703 0.5324027 -0.604234 ] [ -1.4264114 -0.0286184 -0.4894309 ] [ -0.4489209 -0.3148018 -1.2629914 ] [ -0.006362600000000005 -0.282106 1.5168403 ] [ -1.5873817 -1.3511577 -0.0804874 ] [ -0.7287005 -0.9018985 2.2401842 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.409281084242383e-09 2.8814052238456e-09 -1.978646309878197e-09 ] [ -2.731695116697792e-10 8.775891999076205e-10 -1.360356899069414e-10 ] [ 3.589468916594682e-09 8.530031587907962e-10 -9.680895882924673e-10 ] [ -2.285362996722597e-09 -4.585173140470272e-11 -7.841547454771028e-10 ] [ -7.192505705684947e-10 -5.043680841457575e-10 -2.023535293351461e-09 ] [ -1.019400896750209e-11 -4.519836377874048e-10 2.430246066147258e-09 ] [ -2.543265848025759e-09 -2.1647932779539e-09 -1.289550305489779e-10 ] [ -1.16750690466527e-09 -1.445000691034589e-09 3.589170751525552e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.893218 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.750727472487774e-18 } }