aoterodelaroza/critic2

Issues

• rhoplot.f90 stop make process

  #67 opened 3 months ago by alas-go
  4

• QE 7.2: Voronoi charges sum roughly equal to Natoms/2

  #62 opened 3 months ago by tomdemeyere
  8

• NCI plot Isosurface color scheme

  #66 opened 4 months ago by shwetaphd
  0

• f3temp has double defined complex and real

  #65 opened 5 months ago by LZengHui
  1

• Negative values for the reduced density gradient

  #64 opened 7 months ago by pth-lab
  2

• SMOOTHRHO option makes field value zero

  #63 opened 9 months ago by whzhangg
  1

• Unable to install critic2

  #61 opened a year ago by kpmp6
  1

• error reading STO molden files

  #60 opened a year ago by masterofamn2
  5

• Reason: Wannier and reference grids have different number of points

  #59 opened a year ago by netscape88
  1

• critic2 : cp error for smoothrho

  #58 opened a year ago by zanat
  3

• Installation issues

  #57 opened a year ago by PolyuWeldingSpock
  7

• Link to download example data is down

  #55 opened a year ago by cisert
  7

• VMD visualization fails

  #56 opened a year ago by cisert
  2

• unable to build with cmake/ninja from 81dbc0fdb8646f90e1601f237e9eef8c8906cb8f on

  #54 opened 2 years ago by balducci
  2

• Large residual charges in VDD method

  #53 opened 2 years ago by Andrew-S-Rosen
  4

• Question about methods requiring promolecular density

  #52 opened 2 years ago by Andrew-S-Rosen
  10

• Missing bonds and an atom bonded to itself

  #32 opened 2 years ago by samblau
  15

• Missing manual PDF

  #51 opened 2 years ago by Andrew-S-Rosen
  2

• Load crystal or molecule from file

  #48 opened 2 years ago by davidwaroquiers
  5

• Definition scalar fields

  #47 opened 2 years ago by wutobias
  3

• add topic quantum-chemistry

  #50 opened 2 years ago by Beliavsky
  1

• Error using Make

  #49 opened 3 years ago by pies32
  4

• pointprops issue in json file

  #45 opened 3 years ago by wutobias
  7

• Stress tensor pointprop not in json output

  #46 opened 3 years ago by wutobias
  1

• Guix Package for Critic2: Request for Comments

  #44 opened 3 years ago by ecbrown
  3

• Question regarding Morse Sum

  #29 opened 3 years ago by manaslkht
  5

• Request for machine-readable output

  #28 opened 3 years ago by mkhorton
  18

• Installation Issues

  #31 opened 3 years ago by misterblonde
  10

• Redundant variable in struct_drivers@proc.f90

  #42 opened 3 years ago by ecbrown
  2

• Compiler Check error in crystalmod

  #41 opened 3 years ago by ecbrown
  3

• INTEGRALS subscript error

  #39 opened 3 years ago by ecbrown
  6

• Associated Atomic Basin / Attractor Index

  #38 opened 3 years ago by ecbrown
  2

• Compilation issue due to missing module

  #37 opened 4 years ago by franciscoadasme
  2

• Missing comma in json file

  #36 opened 4 years ago by wutobias
  3

• POINTPROP values in json output

  #35 opened 4 years ago by wutobias
  5

• Restrict open computations not allowed

  #34 opened 4 years ago by mvfbarrionuevo
  6

• Line breaks in cp table.

  #30 opened 5 years ago by bjoe2k4
  1

• Unable to generate configure file and configure file not working

  #27 opened 5 years ago by manaslkht
  2

• integration results differ within twice run

  #25 opened 5 years ago by Ceasea
  9

• data incompatible from auto and cube grid

  #24 opened 5 years ago by Ceasea
  2

• integrable clear not working

  #23 opened 5 years ago by Ceasea
  5

• typnuc 3, and then the integration is done around the nuclear still

  #22 opened 5 years ago by Ceasea
  2

• nuclear

  #21 opened 5 years ago by Ceasea
  0

• Units of density and Laplacian?

  #20 opened 5 years ago by gooaah
  2

• Compilation issues, "Cannot read module file..."

  #18 opened 6 years ago by mkhorton
  2

• Inconsistent number format in root-grad.cube

  #17 opened 6 years ago by weixie4
  2

• Master branch compilation error with Intel (17.1/18.2) compiler

  #16 opened 6 years ago by weixie4
  5

• why I can't obtain *.obj and *.xyz documents?

  #14 opened 6 years ago by lorna639
  1

• Segfaults with gfortran 6/7/8 on commit 651ef49

  #15 opened 6 years ago by srk
  7

• Segmentation fault on stable, gfortran 6.4.0/7.3.0/8.0.1

  #13 opened 6 years ago by srk
  6