{ "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" [ [ 9.487277644830855e-10 -1.09576480015675e-09 -1.498160110224422e-10 ] [ 1.093027160964789e-09 9.046001353400256e-10 4.272782345123309e-10 ] [ 5.388602230913261e-10 -2.007062674642368e-10 -3.058409371034707e-10 ] [ -1.030058735849432e-09 4.513273862435252e-10 1.367925581426073e-10 ] [ -5.641167751239552e-11 8.913160083239865e-10 1.653774718872864e-10 ] [ -8.762991272925524e-10 4.296164510727264e-10 -8.517446490551577e-10 ] [ -4.12778856529415e-10 -6.576100294364562e-10 3.332202129409978e-10 ] [ -2.050667513554061e-10 -7.227787237051584e-10 2.447332799155104e-10 ] ] "source-value" [ [ 0.5921493 -0.6839226 -0.0935078 ] [ 0.6822139 0.564607 0.2666861 ] [ 0.3363301 -0.125271 -0.1908909 ] [ -0.6429121 0.2816964 0.0853792 ] [ -0.0352094 0.5563157 0.1032205 ] [ -0.5469429 0.2681455 -0.5316172 ] [ -0.2576363 -0.4104479 0.2079797 ] [ -0.1279926 -0.451123 0.1527505 ] ] } "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" 2.440505924573875e-17 "source-value" 152.3244 } }