density matrix: [[[[ 0.56016062 0.01202778 -0.00006002 0.00164142 -0.0000189 ] [ 0.01202778 0.5465868 0.0000203 -0.00199428 -0.00001706] [-0.00006002 0.0000203 0.54446136 0.00006678 -0.00003108] [ 0.00164142 -0.00199428 0.00006678 0.48839256 0.00013617] [-0.0000189 -0.00001706 -0.00003108 0.00013617 0.54338373]] [[ 0.56260435 0.00750293 -0.00005427 0.00661288 -0.00001657] [ 0.00750293 0.53541612 0.0000371 -0.01036245 -0.00004262] [-0.00005427 0.0000371 0.54445834 0.0000739 -0.00000814] [ 0.00661288 -0.01036245 0.0000739 0.49707557 0.00013642] [-0.00001657 -0.00004262 -0.00000814 0.00013642 0.54337993]]]] overlap matrix: [[[[ 1. -0. -0. 0. 0.] [-0. 1. 0. 0. 0.] [-0. 0. 1. -0. 0.] [ 0. 0. -0. 1. 0.] [ 0. 0. 0. 0. 1.]] [[ 1. -0. -0. -0. -0.] [-0. 1. 0. 0. 0.] [-0. 0. 1. -0. 0.] [-0. 0. -0. 1. -0.] [-0. 0. 0. -0. 1.]]]]