BSE interpolation

jzwanzig · Post by **jzwanzig** » Mon Jan 23, 2017 9:08 pm

Hi, I must be missing something obvious here--I am trying to reproduce data in Gillet, Giantomassi, and Gonze, CPC 203, 83 (2016). Doing a BSE calc with an 8x8x8 k pt mesh works and give an answer similar to the cited paper; doing 4x4x4 with bs_interp_mode 1, bs_interp_method 0, bs_interp_kmult 1 1 1 gives the 4x4x4 answer, while bs_interp_kmult 2 2 2 crashes my machine with an "insufficient virtual memory" error (same machine that runs 8x8x8 without interpolation fine. Any suggestions?

thanks,
Joe