{ "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" [ 5.34161 0 0 ] "si-unit" "m" "si-value" [ 5.341610000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0977669 5.5284 0 ] "si-unit" "m" "si-value" [ -9.776690000000001e-12 5.5284e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.072801 -0.0524088 5.47046 ] "si-unit" "m" "si-value" [ -7.280100000000001e-12 -5.24088e-12 5.470460000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0796719 -0.127908 0.00668105 ] [ 1.22031 1.46092 1.38882 ] [ -0.251468 2.67688 2.66146 ] [ 1.14494 4.10147 3.98362 ] [ 2.6636 -0.086404 2.79747 ] [ 4.00012 1.38046 4.02333 ] [ 2.71061 2.85329 -0.00699576 ] [ 4.09739 4.08725 1.448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.967190000000001e-12 -1.27908e-11 6.68105e-13 ] [ 1.22031e-10 1.46092e-10 1.38882e-10 ] [ -2.51468e-11 2.67688e-10 2.66146e-10 ] [ 1.14494e-10 4.10147e-10 3.98362e-10 ] [ 2.663600000000001e-10 -8.6404e-12 2.79747e-10 ] [ 4.00012e-10 1.38046e-10 4.02333e-10 ] [ 2.71061e-10 2.85329e-10 -6.99576e-13 ] [ 4.09739e-10 4.08725e-10 1.448e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.1233097 2.2642775 -1.3663733 ] [ 1.2475693 -1.5830599 -0.9381455 ] [ 4.5803457 -0.4517876 1.363967 ] [ -0.1552111 -0.9064917 1.7536078 ] [ 0.1101282 0.9462261 -1.9502744 ] [ -2.2281533 -1.6143822 2.921079 ] [ -0.9398701 -0.8135435 -0.4442072 ] [ -4.7381185 2.1587613 -1.3396534 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.401917160057862e-09 3.627772473503472e-09 -2.189171356545345e-09 ] [ 1.998826365287822e-09 -2.536341561105986e-09 -1.503074787008726e-09 ] [ 7.33852279572181e-09 -7.238435302873421e-10 2.185316038942714e-09 ] [ -2.486755957086509e-10 -1.452359808689247e-09 2.809589419212522e-09 ] [ 1.764448273307865e-10 1.516021335410763e-09 -3.124684047824748e-09 ] [ -3.569895124818368e-09 -2.58652541787567e-09 4.680084481309843e-09 ] [ -1.505837900808958e-09 -1.303440375703805e-09 -7.116983906310298e-10 ] [ -7.591302687279964e-09 3.458716884747815e-09 -2.146361357455231e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.189814 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.638029728110053e-18 } }