{ "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" [ 5.47211 0 0 ] "si-unit" "m" "si-value" [ 5.47211e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.102197 5.35978 0 ] "si-unit" "m" "si-value" [ 1.02197e-11 5.35978e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0185088 0.0167086 5.27242 ] "si-unit" "m" "si-value" [ 1.85088e-12 1.67086e-12 5.27242e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0278677 0.000879346 0.114128 ] [ 1.32251 1.35955 1.26618 ] [ 0.0215185 2.57215 2.76138 ] [ 1.39174 4.08684 3.88021 ] [ 2.74481 0.155651 2.83937 ] [ 4.07982 1.36064 4.14567 ] [ 2.72904 2.76199 -0.16614 ] [ 4.049 4.11184 1.31405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.78677e-12 8.79346e-14 1.14128e-11 ] [ 1.32251e-10 1.35955e-10 1.26618e-10 ] [ 2.15185e-12 2.57215e-10 2.76138e-10 ] [ 1.39174e-10 4.08684e-10 3.88021e-10 ] [ 2.74481e-10 1.55651e-11 2.83937e-10 ] [ 4.07982e-10 1.36064e-10 4.14567e-10 ] [ 2.72904e-10 2.76199e-10 -1.6614e-11 ] [ 4.049000000000001e-10 4.11184e-10 1.31405e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1145209 -1.0532564 -0.9555325 ] [ 1.7279188 1.2322808 1.1589358 ] [ 0.4651889 0.3271924 -0.0909189 ] [ -0.9299852 0.3097735 0.2769934 ] [ -0.7153683 -1.1170147 -2.5404349 ] [ 1.8830694 -0.3860276 -1.3309001 ] [ -0.8141505 0.4105156 3.638754 ] [ -0.5021522 0.2765364 -0.1568969 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.78565934408465e-09 -1.687502793690957e-09 -1.530931844527605e-09 ] [ 2.768431126809319e-09 1.974331504286827e-09 1.856819859066097e-09 ] [ 7.453147859761626e-10 5.242200181023816e-10 -1.456681371689826e-10 ] [ -1.490000557405816e-09 4.963118635323989e-10 4.437923532522156e-10 ] [ -1.146146374964302e-09 -1.789654852174519e-09 -4.070225436978127e-09 ] [ 3.017009792880399e-09 -6.184844007990983e-10 -2.132337042408263e-09 ] [ -1.304412907659417e-09 6.577185022124903e-10 5.829926635674035e-09 ] [ -8.045365215516948e-10 4.430601585304776e-10 -2.513765471270346e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.106698 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.464495459849453e-18 } }