{ "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" [ [ 2.2743619 -2.7770126 -0.6657979 ] [ 1.2899803 2.1648703 1.5879122 ] [ 1.333548 -0.2940836 -0.6096161 ] [ -1.373676 0.6455475 0.4846308 ] [ -0.0925449 0.8882922 -0.3603406 ] [ -3.0973704 1.7610277 -2.2915933 ] [ 0.1223105 -2.1218945 1.1070395 ] [ -0.4566093 -0.2667471 0.7477654 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.643929463418268e-09 -4.449264663387022e-09 -1.066725829557736e-09 ] [ 2.06677627795257e-09 3.468504581724282e-09 2.544115802723094e-09 ] [ 2.136579428314598e-09 -4.711738684806989e-10 -9.767126630832749e-10 ] [ -2.200871571754061e-09 1.034281112115888e-09 7.764641374796006e-10 ] [ -1.482732751542739e-10 1.423200995278998e-09 -5.773292848450445e-10 ] [ -4.962534440837944e-09 2.821477409521196e-09 -3.671537209641921e-09 ] [ 1.959630235783584e-10 -3.399649759704105e-09 1.773672805202122e-09 ] [ -7.315687452998534e-10 -4.273759672861997e-10 1.19805224172316e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.756163 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.7287688408114e-18 } }