Assertion `number >=0 && number < info->ext_params.n' failed
Dear Developers,
I get this error:
pw.x: func_info.c:71: xc_func_info_get_ext_params_default_value: Assertion `number >=0 && number < info->ext_params.n' failed.
in PW 6.7 with LibXC 5.1.6 and 5.1.1, input_dft = "LDA_C_PW MGGA_X_RPP09"
or
input_dft = "MGGA_X_RPP09+LDA_C_PW"
This is it, basically.
As much as I know - PW identifies the functionals correctly:
Exchange-correlation= MGGA_X_RPP09+LDA_C_PW
( 0 12 0 0 0 209 0)
According Libxc developers, this is not a Libxc issue.