diff --git a/src/utils/non_sym_diag.f90 b/src/utils/non_sym_diag.f90 index 04279ac..0f44099 100644 --- a/src/utils/non_sym_diag.f90 +++ b/src/utils/non_sym_diag.f90 @@ -3,7 +3,7 @@ subroutine diagonalize_nonsym_matrix(N, A, L, e_re, thr_d, thr_nd, thr_deg, imp_bio, verbose) - ! Diagonalize a non-symmetric matrix + ! Diagonalize a non-symmetric matrix A ! ! Output ! right-eigenvectors are saved in A @@ -278,7 +278,7 @@ subroutine check_biorthog_binormalize(n, m, Vl, Vr, thr_d, thr_nd, stop_ifnot) do i = 1, m if(S(i,i) <= 0.d0) then - print *, ' overap negative' + print *, ' negative overlap !' print *, i, S(i,i) exit endif diff --git a/tests/lunch_bench.py b/tests/lunch_bench.py index be543b5..02d6db5 100644 --- a/tests/lunch_bench.py +++ b/tests/lunch_bench.py @@ -123,7 +123,7 @@ class Quack_Job: sys.stdout.flush() idx = (idx + 1) % len(spinner) time.sleep(0.05) - stdout_col(f'\r Testing {self.methd} ({self.basis}) \n', "cyan") + stdout_col(f'\r Testing {self.methd} ({self.basis}) \n\n', "cyan") done_event = threading.Event() spinner_thread = threading.Thread(target=display_spinner) @@ -180,7 +180,7 @@ class Quack_Job: else: diff = abs(data_new[key] - data_ref[key]) / (1e-15 + abs(data_ref[key])) if(diff <= THRESH): - print_col(f" 🙂 {key}: ✔ī¸ ", "green") + print_col(f" 🙂 {key}", "green") else: print_col(f" ☚ī¸ {key}: ❌ {data_ref[key]} ≠ {data_new[key]}", "red") except FileNotFoundError: