4afd9cf2c1
Merge branch 'master' into add-inquire-functionality
2022-01-20 14:32:50 +01:00
5e82e0fc57
add tests for trexio_info
2022-01-20 14:22:32 +01:00
78c632f93f
Merge pull request #74 from TREX-CoE/build_fixes
...
Build fixes
2022-01-19 19:33:23 +01:00
e9db0c66d4
add tests
2022-01-19 14:08:38 +01:00
Pablo Lopez Rios
12a7454c0c
Fix cmake compilation.
...
This includes:
* Declare generated source files in include/ as GENERATED in
TREXIO_DEVEL mode.
* Generate include/config.h with version components from project
delcaration, and for good measure have src/templates_front/build.sh
set version components to 0 if not present.
2022-01-18 14:04:00 +00:00
fafb155228
return the number of read elements if read_sparse reached EOF
2021-12-16 11:05:57 +01:00
ba758e991f
improve tests
2021-12-14 17:46:04 +01:00
b90abcc307
fix memory leak in the Fortran test
2021-12-13 09:59:27 +01:00
9f5ee463e1
only shift indices that have been read to the buffer (EOF case)
2021-12-10 14:02:05 +01:00
7afb53be49
implement shift of sparse indices to be one-based in Fortran
2021-12-10 11:34:37 +01:00
2731b5dd6b
add tests for I/O of floating point attributes
2021-12-09 16:23:22 +01:00
e00f3b106e
working HDF5 I/O for sparse indices
2021-12-09 16:13:28 +01:00
e774cb6852
add read_size function to HDF5 back end
2021-12-09 14:10:51 +01:00
ddcfff0f83
add the unit test for HDF5 back end
2021-12-08 17:24:16 +01:00
46a381550e
adapt Fortran test to proper indices for sparse data
2021-12-07 14:43:42 +01:00
1ad20c1cb9
add a test of reading a chunk that can reach EOF
2021-12-03 19:24:49 +01:00
1bb8ae5b67
unit testing for sparse data in C
2021-12-03 11:06:31 +01:00
7e83e6698d
add Fortran test for reading sparse data size
2021-12-02 17:35:06 +01:00
f9fd18caa3
add assert to check the read values
2021-12-01 13:36:29 +01:00
c30c3a532c
add Fortran interface for sparse data
2021-12-01 13:35:42 +01:00
83c926fd6b
replace offset_data arg with pointer arithmetics
2021-12-01 09:56:31 +01:00
db4b66d81d
[WIP] add C test for sparse I/O in text back end
2021-11-30 16:33:30 +01:00
72c355c7cc
Top-level CMakeLists with subdirectories
2021-11-17 14:00:35 +01:00
e18dcd5c4a
conditional HDF5 tests based on the trexio_has_backend function
2021-11-02 11:06:03 +01:00
c24484b86a
adapt tests to optional HDF5
2021-11-01 11:57:03 +01:00
7459589701
adapt the tests to use basis_shell_num
2021-10-21 15:52:12 +02:00
db35b102ed
fix tests broken due to new dimension of basis_nucleus_index
2021-10-19 10:22:08 +02:00
fb9c95bd61
add version attributes to the Fortran module
2021-10-08 13:55:56 +02:00
8ef0c1963f
add unit tests in C for trexio_open errors
2021-09-22 16:43:18 +02:00
9457a826d2
return error code from trexio_open [C, Fortran]
2021-09-22 14:50:22 +02:00
187b15ddd6
fix io_num tests
2021-09-22 11:41:29 +02:00
788f7e666d
read single numerical attributes based on _isSet bool flag
2021-09-21 15:41:12 +02:00
2854d617d4
make python directory and adapt build process
2021-08-05 12:55:18 +03:00
60c28c1f3b
rename python test and add temporary TODO
2021-08-04 14:13:23 +03:00
da5a990acc
add memory-safe API for numerical datasets
2021-07-28 10:19:00 +02:00
58c6de9963
shift values in the basic_nucleus_index array
2021-06-23 16:51:33 +02:00
05eb291ed4
rename TREXIO files to execute tests in parallel
2021-06-22 17:57:34 +02:00
2ba109a404
add tests for open/close
2021-06-22 15:59:35 +02:00
5cc1d13c36
add C unit tests
2021-06-21 12:55:16 +02:00
c010331114
fix names and typos
2021-06-21 12:51:21 +02:00
91319ec3e8
ignore produced binary and .o test files
2021-06-21 12:49:59 +02:00
d4f0b731a5
add assert to read
2021-06-21 09:28:37 +02:00
dfa2604820
complete num attribute testing
2021-06-18 12:53:00 +02:00
fd424c2149
[WIP] unit testing for C API
2021-06-17 17:20:01 +02:00
ac45a937af
Merge branch 'master' into add-strings
2021-06-15 11:49:42 +02:00
0909a128d2
minor cleaning in the C test
2021-06-15 11:26:22 +02:00
da188dbea0
add top-level read/write functions for single strings [fortran]
2021-06-15 11:26:03 +02:00
b92a15cce7
add top-level read/write functions for string arrays [fortran]
2021-06-15 10:20:01 +02:00
5553e9110e
add top-level read/write functions that accept arrays of strings directly
2021-06-14 15:40:26 +02:00
4287d76de2
introduce calls to trexio_assert and trexio_strarray2str subroutines
2021-06-14 11:54:10 +02:00
