{ "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" [ [ 3.853128068061055e-09 -4.486767452420736e-09 -1.480846348789409e-09 ] [ 2.211166517848673e-09 3.752459145316977e-09 2.500409866466628e-09 ] [ 2.219825160960463e-09 -8.239142002812134e-10 -1.131468825498292e-09 ] [ -2.727570473205205e-09 1.540824311242044e-09 1.079452879762723e-09 ] [ 9.029498934206016e-11 1.326032027363057e-09 -4.433413368771475e-10 ] [ -4.737718138930923e-09 2.79187287057504e-09 -3.369992509147125e-09 ] [ 1.628127075527098e-10 -3.452194263506876e-09 1.484602491659213e-09 ] [ -1.071938671411171e-09 -6.483124382882919e-10 1.361183782423409e-09 ] ] "source-value" [ [ 2.4049334 -2.80042 -0.9242716 ] [ 1.3801016 2.3421008 1.5606331 ] [ 1.3855059 -0.5142468 -0.7062073 ] [ -1.7024156 0.9617069 0.6737415 ] [ 0.0563577 0.8276441 -0.2767119 ] [ -2.9570511 1.74255 -2.1033839 ] [ 0.1016197 -2.1546902 0.926616 ] [ -0.6690515 -0.4046448 0.8495841 ] ] } "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" -5.697543700213304e-18 "source-value" -35.561271 } }