{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46438e-10 0.0 0.0 ] "source-value" [ 5.46438 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] "source-value" [ 0.0372754 5.43203 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] "source-value" [ 0.17857 -0.0223871 5.50346 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.55828785602238e-09 -6.194883195741274e-10 -5.052677864271678e-09 ] [ 4.011576927151691e-09 1.791412585400606e-09 4.118645584189893e-09 ] [ 1.120570659905948e-09 1.680111939036223e-09 -2.579033800214471e-09 ] [ -1.85325387926323e-09 -2.033897691081809e-09 8.377055764153978e-10 ] [ 1.897473793779648e-10 3.729475120603291e-09 -1.990557371530211e-09 ] [ -1.269330676317621e-09 -2.208929078197726e-09 4.260575361449433e-09 ] [ -6.379074226598305e-10 -1.242600602446842e-09 -2.925082160705228e-09 ] [ 9.968850280451193e-10 -1.096083953739613e-09 3.330424674666862e-09 ] ] "source-value" [ [ -1.5967577 -0.3866542 -3.1536335 ] [ 2.5038294 1.1181118 2.5706564 ] [ 0.6994052 1.0486434 -1.6097063 ] [ -1.1567101 -1.2694591 0.5228547 ] [ 0.118431 2.3277553 -1.2424082 ] [ -0.7922539 -1.3787051 2.659242 ] [ -0.3981505 -0.7755703 -1.8256927 ] [ 0.6222067 -0.6841218 2.0786876 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.768783362133541e-18 "source-value" -36.005914 } }