[Wien] Run-time problem

2009-06-12 Thread Debojyoti Mukherjee
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[Wien] tetra produces NaN

2009-06-12 Thread Ulrich Wedig
Dear colleagues, when using tetra (WIEN2k 9.1), compiled with the Intel Fortran compiler 11.0, occasionally the calculation of DOS and partial DOSs results in 'NaN' for single energy values. This is a matter of numerical precision. When compiling tetra with the option: -fp-model precise , which