diff options
| author | Thomas White <taw@physics.org> | 2019-08-09 13:59:47 +0200 |
|---|---|---|
| committer | Thomas White <taw@physics.org> | 2019-08-16 10:27:00 +0200 |
| commit | 88b2fdfb4a43c6cb9104b9d9dd9b63d422846d0a (patch) | |
| tree | 1fd50f59a19988162fb479fd9af1a1acd22289e8 /tests | |
| parent | 41d5529aa1a6ef6c29c59d4c39767de61c57df12 (diff) | |
Pass transformation matrix for debugging
Diffstat (limited to 'tests')
| -rw-r--r-- | tests/cellcompare_check.c | 19 |
1 files changed, 12 insertions, 7 deletions
diff --git a/tests/cellcompare_check.c b/tests/cellcompare_check.c index b3810378..44ba9307 100644 --- a/tests/cellcompare_check.c +++ b/tests/cellcompare_check.c @@ -180,7 +180,7 @@ static int check_cpcpao(UnitCell *cell, UnitCell *cref, double *tols, static int check_crcp(UnitCell *cell, UnitCell *cref, double *tols, - int should_match) + RationalMatrix *tr, int should_match) { RationalMatrix *m = NULL; const char *a; @@ -189,9 +189,14 @@ static int check_crcp(UnitCell *cell, UnitCell *cref, double *tols, a = should_match ? "" : "NOT "; b = " with compare_reindexed_cell_parameters"; - if ( compare_reindexed_cell_parameters(cell, cref, tols, 0, &m) != should_match ) + if ( compare_reindexed_cell_parameters(cref, cell, tols, 1, &m) != should_match ) { complain(cell, cref, a, b); + STATUS("The transformation matrix to create the cell was:\n"); + rtnl_mtx_print(tr); + STATUS("Cell comparison says do this to the reference to " + "create the cell:\n"); + rtnl_mtx_print(m); rtnl_mtx_free(m); return 1; } @@ -227,7 +232,7 @@ int main(int argc, char *argv[]) if ( check_cpcp(cell, cref, tols, 1) ) return 1; if ( check_ccpao(cell, cref, tols, 0) ) return 1; if ( check_cpcpao(cell, cref, tols, 0) ) return 1; - if ( check_crcp(cell, cref, tols, 1) ) return 1; + if ( check_crcp(cell, cref, tols, NULL, 1) ) return 1; cell_free(cell); } @@ -245,7 +250,7 @@ int main(int argc, char *argv[]) if ( check_cpcp(cell, cref, tols, 1) ) return 1; if ( check_ccpao(cell, cref, tols, intmat_is_identity(tr)) ) return 1; if ( check_cpcpao(cell, cref, tols, 1) ) return 1; - if ( check_crcp(cell, cref, tols, 1) ) return 1; + if ( check_crcp(cell, cref, tols, NULL, 1) ) return 1; cell_free(cell); intmat_free(tr); @@ -269,7 +274,7 @@ int main(int argc, char *argv[]) if ( check_cpcp(cell, cref, tols, 1) ) return 1; if ( check_ccpao(cell, cref, tols, 0) ) return 1; if ( check_cpcpao(cell, cref, tols, 0) ) return 1; - if ( check_crcp(cell, cref, tols, 1) ) return 1; + if ( check_crcp(cell, cref, tols, NULL, 1) ) return 1; cell_free(cell); intmat_free(tr); @@ -294,7 +299,7 @@ int main(int argc, char *argv[]) if ( check_cpcp(cell, cref, tols, rtnl_mtx_is_perm(tr)) ) return 1; if ( check_ccpao(cell, cref, tols, rtnl_mtx_is_identity(tr)) ) return 1; if ( check_cpcpao(cell, cref, tols, rtnl_mtx_is_perm(tr)) ) return 1; - if ( check_crcp(cell, cref, tols, 1) ) return 1; + if ( check_crcp(cell, cref, tols, tr, 1) ) return 1; cell_free(cell); rtnl_mtx_free(tr); @@ -324,7 +329,7 @@ int main(int argc, char *argv[]) if ( check_cpcp(cell, cref, tols, rtnl_mtx_is_perm(tr)) ) return 1; if ( check_ccpao(cell, cref, tols, 0) ) return 1; if ( check_cpcpao(cell, cref, tols, 0) ) return 1; - if ( check_crcp(cell, cref, tols, 1) ) return 1; + if ( check_crcp(cell, cref, tols, tr, 1) ) return 1; cell_free(cell); rtnl_mtx_free(tr); |