{ "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" [ [ -1.72194316842869e-09 -3.849893593898984e-09 4.133800733063702e-09 ] [ 7.716858059257267e-09 -5.329317209849123e-09 7.861584916461402e-09 ] [ -7.001841560844561e-09 5.605469013080859e-09 8.885608252980278e-09 ] [ 4.751910059220307e-09 -5.276981469660043e-09 -9.156868931424036e-09 ] [ -5.361735811812052e-09 -3.397312664667345e-09 -3.178792115791757e-09 ] [ -1.436117582978226e-09 1.157782782057117e-08 -1.240845193654029e-08 ] [ 6.296408642106831e-09 5.932002381677287e-09 -1.921677875990074e-10 ] [ -3.243538476303216e-09 -5.261794277253817e-09 4.055286708632047e-09 ] ] "source-value" [ [ -1.0747524 -2.4029146 2.5801155 ] [ 4.816484 -3.3262982 4.9068154 ] [ -4.3702058 3.4986586 5.5459605 ] [ 2.965909 -3.2936328 -5.7152681 ] [ -3.3465323 -2.1204358 -1.984046 ] [ -0.8963541 7.2263118 -7.7447466 ] [ 3.9299092 3.7024647 -0.1199417 ] [ -2.0244575 -3.2841537 2.5311109 ] ] } "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" -2.837764816612925e-18 "source-value" -17.711935 } }