Package Details: dftd4 2.5.0-2

Git Clone URL: https://aur.archlinux.org/dftd4.git (read-only, click to copy)
Package Base: dftd4
Description: A Generally Applicable Atomic-Charge Dependent London Dispersion Correction
Upstream URL: https://github.com/dftd4/dftd4
Licenses: LGPL3
Submitter: awvwgk
Maintainer: awvwgk
Last Packager: awvwgk
Votes: 1
Popularity: 0.001590
First Submitted: 2020-01-10 12:40
Last Updated: 2020-06-11 07:45

Latest Comments

awvwgk commented on 2020-06-11 07:53

Fixed this upstream with https://github.com/dftd4/dftd4/pull/45 and updated the patch here to account for those changes as well.

berquist commented on 2020-06-11 02:00

This is not building with GCC 10.1.0 (and neither is the Git package):

[57/65] Compiling Fortran object 'd4test@exe/tests_eeq_model.f90.o'
FAILED: d4test@exe/tests_eeq_model.f90.o 
gfortran -Id4test@exe -I. -I.. -I../include -Idftd4@sta -fdiagnostics-color=always -pipe -O3 -fbacktrace -std=f2008 -fbounds-check -fopenmp -Wl,-O1,--sort-common,--as-needed,-z,relro,-z,now -D_FILE_OFFSET_BITS=64 -pthread -Jd4test@exe -o 'd4test@exe/tests_eeq_model.f90.o' -c ../tests/eeq_model.f90
../tests/eeq_model.f90:246:33:

  246 |    call generate_wsc(mol,mol%wsc)
      |                                 1
Error: Missing actual argument for argument ‘_formal_3’ at (1)
../tests/eeq_model.f90:343:33:

  343 |    call generate_wsc(mol,mol%wsc)
      |                                 1
Error: Missing actual argument for argument ‘_formal_3’ at (1)
[59/65] Compiling Fortran object 'd4test@exe/tests_dftd4.f90.o'
FAILED: d4test@exe/tests_dftd4.f90.o 
gfortran -Id4test@exe -I. -I.. -I../include -Idftd4@sta -fdiagnostics-color=always -pipe -O3 -fbacktrace -std=f2008 -fbounds-check -fopenmp -Wl,-O1,--sort-common,--as-needed,-z,relro,-z,now -D_FILE_OFFSET_BITS=64 -pthread -Jd4test@exe -o 'd4test@exe/tests_dftd4.f90.o' -c ../tests/dftd4.f90
../tests/dftd4.f90:394:41:

  394 |    call generate_wsc(mol,mol%wsc,wsc_rep)
      |                                         1
Error: More actual than formal arguments in procedure call at (1)
../tests/dftd4.f90:532:41:

  532 |    call generate_wsc(mol,mol%wsc,wsc_rep)
      |                                         1
Error: More actual than formal arguments in procedure call at (1)