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Merge pull request #163 from MuyamiYatara/master
fixed some typo bugs in output
2 parents bbcae16 + d2049db commit 2ad4152

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src/ek_bulk.f90

Lines changed: 2 additions & 2 deletions
Original file line numberDiff line numberDiff line change
@@ -114,8 +114,8 @@ subroutine ek_bulk_line
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outfileindex= outfileindex+ 1
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open(unit=outfileindex, file=filename)
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write(outfileindex, '(a, a6, a, a6)')'# segment between', k3line_name(il), ' and ', k3line_name(il+1)
117-
write(outfileindex, '(a, 3f10.6)')'# kstart (fractional units)', k3line_start(:, il)*Angstrom2atomic
118-
write(outfileindex, '(a, 3f10.6)')'# kend (fractional units)', k3line_end(:, il)*Angstrom2atomic
117+
write(outfileindex, '(a, 3f10.6)')'# kstart (fractional units)', k3line_start(:, il)!*Angstrom2atomic !fractional units
118+
write(outfileindex, '(a, 3f10.6)')'# kend (fractional units)', k3line_end(:, il)!*Angstrom2atomic
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120120
do i=1, Num_wann
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do ik=1+(il-1)*Nk1, il*Nk1

src/readinput.f90

Lines changed: 3 additions & 3 deletions
Original file line numberDiff line numberDiff line change
@@ -1646,9 +1646,9 @@ subroutine readinput
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if (cpuid.eq.0) then
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write(stdout, *)" "
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write(stdout, *)"The rotated new unit cell in cartesian coordinates : "
1649-
write(stdout, '(3f12.6)') R1
1650-
write(stdout, '(3f12.6)') R2
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write(stdout, '(3f12.6)') R3
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write(stdout, '(3f12.6)') R1/Angstrom2atomic ! in unit of Angstrom
1650+
write(stdout, '(3f12.6)') R2/Angstrom2atomic
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write(stdout, '(3f12.6)') R3/Angstrom2atomic
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call get_volume(R1, R2, R3, cell_volume2)
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write(stdout, '(a, f18.5, a)')"New cell's Volume is ", cell_volume2/(Angstrom2atomic**3), 'Ang^3'

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