{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43385e-10 0.0 0.0 ] "source-value" [ 5.43385 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.31251e-12 5.415630000000001e-10 0.0 ] "source-value" [ 0.0231251 5.41563 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.581680000000001e-12 8.29392e-12 5.41654e-10 ] "source-value" [ -0.0358168 0.0829392 5.41654 ] } "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" [ [ -1.721940925381421e-09 -3.84989791977586e-09 4.133803136328634e-09 ] [ 7.716859661433889e-09 -5.329315928107826e-09 7.861586037985035e-09 ] [ -7.001841240409237e-09 5.605469013080859e-09 8.885608092762616e-09 ] [ 4.751909097914335e-09 -5.276980989007057e-09 -9.15686925185936e-09 ] [ -5.36173565159439e-09 -3.397312184014359e-09 -3.178792115791757e-09 ] [ -1.436121107766791e-09 1.157783118514207e-08 -1.240845578176418e-08 ] [ 6.296409122759817e-09 5.932001420371313e-09 -1.921673069460211e-10 ] [ -3.243538956956202e-09 -5.261794757906804e-09 4.055287189285033e-09 ] ] "source-value" [ [ -1.074751 -2.4029173 2.580117 ] [ 4.816485 -3.3262974 4.9068161 ] [ -4.3702056 3.4986586 5.5459604 ] [ 2.9659084 -3.2936325 -5.7152683 ] [ -3.3465322 -2.1204355 -1.984046 ] [ -0.8963563 7.2263139 -7.744749 ] [ 3.9299095 3.7024641 -0.1199414 ] [ -2.0244578 -3.284154 2.5311112 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.33361e-11 7.45448e-12 1.00028e-11 ] [ 1.34132e-10 1.25343e-10 1.22744e-10 ] [ -6.90566e-12 2.71113e-10 2.67907e-10 ] [ 1.35774e-10 4.108290000000001e-10 3.9369e-10 ] [ 2.76453e-10 -1.5077e-12 2.69424e-10 ] [ 4.18319e-10 1.35081e-10 4.129380000000001e-10 ] [ 2.74151e-10 2.8117e-10 -1.50387e-11 ] [ 4.06649e-10 4.0541e-10 1.2862e-10 ] ] "source-value" [ [ -0.133361 0.0745448 0.100028 ] [ 1.34132 1.25343 1.22744 ] [ -0.0690566 2.71113 2.67907 ] [ 1.35774 4.10829 3.9369 ] [ 2.76453 -0.015077 2.69424 ] [ 4.18319 1.35081 4.12938 ] [ 2.74151 2.8117 -0.150387 ] [ 4.06649 4.0541 1.2862 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.837764656395263e-18 "source-value" -17.711934 } }