mirror of
https://github.com/LCPQ/quantum_package
synced 2025-01-03 10:05:57 +01:00
Fix broken QMCPack pseudo (#219)
* Fixes #211 * Removed debug print * Revert input coordinates * Fix MPI * Multi-state modification for qmcpack * Removed useless file * Fixed QMCPack pseudo bug
This commit is contained in:
parent
e70bf2800e
commit
279c225f3b
@ -26,7 +26,7 @@ if do_pseudo:
|
||||
|
||||
l_element_raw = data_raw.split("\n")
|
||||
l_element = [element_raw.split() for element_raw in l_element_raw]
|
||||
d_z = dict((abr, z) for (z, abr, ele) in l_element)
|
||||
d_z = dict((abr, z) for (z, abr, ele, _) in filter(lambda x: x != [], l_element) )
|
||||
else:
|
||||
print "do_pseudo False"
|
||||
|
||||
|
Loading…
Reference in New Issue
Block a user