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GBTOlib: library for evaluation of molecular integrals in mixed Gaussian / B-spline basis 111
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Data Types | |
| type | sparse_block_storage_gbl::sparse_block_storage_obj |
| Storage of integral blocks. More... | |
Modules | |
| module | sparse_block_storage_gbl |
| Storage for blocks in sparse transformation. | |
Functions/Subroutines | |
| subroutine | sparse_block_storage_gbl::reset (this, nblocks, scratch) |
| Initialize block storage. | |