Connor Aird

* De-duplicating code in exx_kernel_default.f90 * Adding omp threading to `m_kern_exx_eri(_gto)` * Adding reframe run-only test for exx benchmarks

f-exx-opt: Results are dependent on compiler/library versions and # of MPI ranks

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# Description In the branch [f-exx-opt](https://github.com/OrderN/CONQUEST-release/tree/f-exx-opt) the Conquest_out results appear to be dependent on the compiler/libraries and the number of MPI ranks you use. # Compiler and library versions and...

Allow cli option to specify a directory for the build other than build/

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### Description Currently fpm enforces the naming of the output build director to be `build`. It would be useful to be able specify a different directory for this build dir,...

Ability to pass any compiler flags directly to the compiler

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### Description It would be very useful to pass compiler flags from the fpm.toml file directly to the compilation commands. It seems that currently it is possible to pass very...

Add user-defined-flags to fortran in toml

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A possible solution to [issue 1096](https://github.com/fortran-lang/fpm/issues/1096). ## Description I have added a new option/line under `[fortran]` for fpm.toml files such that we can now add ```toml name = "some-project" [fortran]...

To explore a codebase I often click through the src, from a procedure call to the implementation of the procedure being called. For example ```f90 call some_procedure(x, y, z) ```...

How to benchmark functions that return generators

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### Is Your Feature Request Related to a Problem? Please Describe Naively wrapping a function in the `benchmark` fixture does not provide a true benchmark of the function as each...

# Description Add benchmark tests for `glass.fields` and `glass.harmonics` for any functions which have both been identified as worth benchmarking in #790 and do not return Generators. Generator functions will...

Use different failure metrics for different "speed" benchmarks

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### Is Your Feature Request Related to a Problem? Please Describe Some benchmarks run on the order of microseconds and some take longer. The impact of a 10% change is...

`fields.effective_cls` is still calling np

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### Describe the Bug Although `fields.effective_cls` was ported in #407 `np` is still being called directly... ```py pairs = ( combinations_with_replacement(np.ndindex(shape1[1:]), 2) if weights2 is weights1 else product(np.ndindex(shape1[1:]), np.ndindex(shape2[1:])) )...