{ "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" [ 5.43385 0 0 ] "si-unit" "m" "si-value" [ 5.43385e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0231251 5.41563 0 ] "si-unit" "m" "si-value" [ 2.31251e-12 5.415630000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0358168 0.0829392 5.41654 ] "si-unit" "m" "si-value" [ -3.581680000000001e-12 8.29392e-12 5.41654e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3199006 -1.4966939 -0.0545841 ] [ 1.5919162 1.2861178 0.6166148 ] [ 0.8212774 -0.370418 -0.4558031 ] [ -1.4333978 0.6251988 0.0662053 ] [ -0.0877226 1.2113239 0.2338893 ] [ -1.1814214 0.6803563 -1.1394187 ] [ -0.6500376 -0.8752135 0.3229339 ] [ -0.3805148 -1.0606714 0.4101627 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.114713883099892e-09 -2.397967975073973e-09 -8.745336888740929e-11 ] [ 2.550530917912777e-09 2.06058787075473e-09 9.879258165992679e-10 ] [ 1.31583144947141e-09 -5.934750595234945e-10 -7.302770705081645e-10 ] [ -2.296556443466154e-09 1.001678900712215e-09 1.060725838330502e-10 ] [ -1.405470988357901e-10 1.940754832796277e-09 3.747319683152775e-10 ] [ -1.892845746392805e-09 1.090050957673991e-09 -1.825550002442329e-09 ] [ -1.041475045360942e-09 -1.402246607908541e-09 5.173971446437651e-10 ] [ -6.096519164283879e-10 -1.699382919431205e-09 6.571530886642041e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 154.19325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.470448202351696e-17 } }