{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.2932938 6.1990552 5.6352398 ] [ -4.6166279 -2.9635488 2.653259 ] [ 0.6562116 0.33468880000000006 -3.0875922 ] [ 5.6387677 -5.5014983 -3.2323282 ] [ -3.8554855 -1.9918485 -3.9353429 ] [ 5.3345822 2.7005296 6.8263892 ] [ 1.0702274 2.4043246 -3.9064618 ] [ 3.0656183 -1.1817027 -0.9531629 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.168514481498559e-08 9.931981312488669e-09 9.028649460161668e-09 ] [ -7.396653288313e-09 -4.748128601959895e-09 4.250989538727187e-09 ] [ 1.051366883817761e-09 5.362305706036071e-10 -4.946868037404438e-09 ] [ 9.03430177906219e-09 -8.814371955630945e-09 -5.178760672792547e-09 ] [ -6.177168729933398e-09 -3.191293098875549e-09 -6.305114389211273e-09 ] [ 8.54694288257583e-09 4.326725388898376e-09 1.093708118072162e-08 ] [ 1.71469331921957e-09 3.852152662934312e-09 -6.258841766008286e-09 ] [ 4.911661968556641e-09 -1.893296438676236e-09 -1.527135314193928e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.1818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.636745743766144e-18 } }