Comments (2)
Just to note, reordering would result at least in ABI breakage.
Also, those parameters are usually not used in arrays, but I'm fine with adjusting this to account for the warnings.
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This is also resolved with v3.0.0
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Related Issues (20)
- Build fails: meson-python: error: The dftd4 package is split between purelib and platlib: 'purelib/dftd4/__init__.py' and 'platlib/dftd4/_libdftd4.cpython-39.so', a "pure: false" argument may be missing in meson.build. It is recommended to set it in "import('python').find_installation()" HOT 1
- The 3.6.0 release isn't on PYPI HOT 4
- Failed to build VASP 6.2.1 with DFT-D4 3.6.0 using ifort 2023.1.0 HOT 2
- Failed to link targets when building VASP+DFTD4 HOT 5
- Segfault when structure is large HOT 4
- Segfault when above ~700 atoms using ASE HOT 5
- Add r2SCAN-3c and wB97X-3c parameters HOT 3
- Do vasp implementations of DFT-D3 and D4 contain the ATM three-body term? HOT 2
- Non-zero D4 interaction energy in dissociation limit HOT 7
- Spurious forces for PdAg system HOT 3
- Changes from older version of dftd4 HOT 1
- Duplicate `-qopenmp` flag in dftd4.pc file. HOT 4
- Inquiry on Fortran Compiler Version Matching Requirements for Building Vasp with dftd4 Support. HOT 1
- About the `Skipped` testing examples. HOT 1
- About the directory `libdftd4.a.p`. HOT 1
- Applying vdW Dispersion Correction in DFPT Calculations with DFT-D4. HOT 1
- ld is unable to find library during linking process
- D4 dispersion with B97D functional HOT 1
- Energy is changing depending on number of OMP_THREADS HOT 4
- Trouble building using AOCC compilers on AMD EPYC processors (NERSC Perlmutter) HOT 4
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