{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.40836e-10 0.0 0.0 ] "source-value" [ 5.40836 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 6.76972e-12 5.561689999999999e-10 0.0 ] "source-value" [ 0.0676972 5.56169 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.90382e-12 4.56166e-12 5.46301e-10 ] "source-value" [ 0.0290382 0.0456166 5.46301 ] } "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" [ [ -1.920045258013478e-10 -6.59167505329536e-11 -2.419137694982266e-10 ] [ 1.949752816916352e-11 -2.107541579239219e-10 9.398896775897665e-11 ] [ -6.76222675457952e-10 1.528910686107437e-10 7.047846780769536e-11 ] [ 5.014636583675711e-11 4.983863577320007e-10 -2.066322381315898e-10 ] [ 4.259010034890912e-10 -4.650455429061388e-10 3.208107141422534e-10 ] [ 5.003506262691015e-10 -5.373253378885997e-10 -5.305337111930285e-10 ] [ -2.148131121750566e-10 1.71751411137815e-10 6.02474485602528e-11 ] [ 8.71447896702432e-11 4.560132722063789e-10 4.335541205536665e-10 ] ] "source-value" [ [ -0.1198398 -0.041142 -0.1509907 ] [ 0.0121694 -0.1315424 0.0586633 ] [ -0.422065 0.0954271 0.0439892 ] [ 0.0312989 0.3110683 -0.1289697 ] [ 0.2658265 -0.2902586 0.2002343 ] [ 0.3122943 -0.3353721 -0.3311331 ] [ -0.1340758 0.1071988 0.0376035 ] [ 0.0543915 0.2846211 0.2706032 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.60852e-11 -1.74641e-12 4.14383e-12 ] [ 1.3693e-10 1.3835e-10 1.35672e-10 ] [ 1.68786e-11 2.76991e-10 2.61562e-10 ] [ 1.32577e-10 4.008910000000001e-10 4.07743e-10 ] [ 2.71647e-10 6.728760000000001e-12 2.67609e-10 ] [ 4.01486e-10 1.47906e-10 4.19059e-10 ] [ 2.74225e-10 2.69331e-10 -4.28987e-12 ] [ 4.04746e-10 4.06755e-10 1.1226e-10 ] ] "source-value" [ [ 0.160852 -0.0174641 0.0414383 ] [ 1.3693 1.3835 1.35672 ] [ 0.168786 2.76991 2.61562 ] [ 1.32577 4.00891 4.07743 ] [ 2.71647 0.0672876 2.67609 ] [ 4.01486 1.47906 4.19059 ] [ 2.74225 2.69331 -0.0428987 ] [ 4.04746 4.06755 1.1226 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.742516818127881e-18 "source-value" 29.600462 } }