Alfredot75
Programmer
May I request some help?
This is the big data block I got:
Mode 1 2 3 4 5 6
Symmetry: 1 B1G 1 E2U 1 E2U 1 B2U 1 E2G 1 E2G
mu 504.72215 550.38168 550.38333 579.74361 673.09113 673.11267
l( 1x) -0.00000 0.00004 -0.00002 -0.35218 0.26965 -0.40252
l( 1y) -0.00001 -0.00002 0.00001 0.20647 0.01705 0.31354
l( 1z) -0.40826 -0.09727 -0.56909 0.00003 -0.00000 -0.00000
l( 2x) 0.00001 -0.00000 -0.00000 -0.00271 -0.01393 -0.16470
l( 2y) 0.00000 0.00005 -0.00003 -0.40825 0.55016 -0.05782
l( 2z) 0.40825 -0.44422 0.36878 -0.00007 0.00000 0.00001
l( 3x) -0.00000 -0.00004 0.00003 0.35490 -0.34942 -0.34037
l( 3y) 0.00000 -0.00002 0.00002 0.20177 -0.04509 -0.30554
l( 3z) -0.40824 0.54149 0.20032 0.00004 -0.00000 -0.00000
l( 4x) 0.00000 0.00004 -0.00003 -0.35219 -0.26966 0.40251
l( 4y) -0.00001 -0.00003 0.00002 0.20648 -0.01705 -0.31354
l( 4z) 0.40824 -0.09727 -0.56910 0.00004 0.00000 -0.00000
l( 5x) 0.00001 0.00000 -0.00000 -0.00272 0.01394 0.16469
l( 5y) 0.00001 0.00004 -0.00003 -0.40824 -0.55016 0.05781
l( 5z) -0.40825 -0.44421 0.36879 -0.00008 0.00000 0.00001
l( 6x) -0.00001 -0.00003 0.00003 0.35489 0.34941 0.34038
l( 6y) 0.00000 -0.00002 0.00001 0.20177 0.04510 0.30554
l( 6z) 0.40826 0.54148 0.20030 0.00005 -0.00000 -0.00000
Working second column:
Mode 1
Symmetry: 1 B1G
mu 504.72215
l( 1x) -0.00000 |
l( 1y) -0.00001 |first 3 rows
l( 1z) -0.40826 |
l( 2x) 0.00001 *
l( 2y) 0.00000 * second block of rows
l( 2z) 0.40825 *
l( 3x) -0.00000 +
l( 3y) 0.00000 + third block of rows
l( 3z) -0.40824 +
l( 4x) 0.00000 -
l( 4y) -0.00001 - 4
l( 4z) 0.40824 -
l( 5x) 0.00001 /
l( 5y) 0.00001 / 5
l( 5z) -0.40825 /
l( 6x) -0.00001 #
l( 6y) 0.00000 # 6
l( 6z) 0.40826 #
There is in the second column a small data blocks. I need to order it in the next way:
-0.00000 -0.00001 -0.40826 <-- elements in first 3 rows
0.00001 0.00000 0.40825 <-- Elements in second block of rows
-0.00000 0.00000 -0.40824 <---elements in 4
0.00000 -0.00001 0.40824
0.00001 0.00001 -0.40825
-0.00001 0.00000 0.40826
The last process is used to the next columns (3-7).
All elements in the third colum need to be added to the end of last small block in the same way that was order in the last problem.
So at the end I will get 6 small data blocks with a blank line between those.
Can anybody help me?
Thnaks in advance
This is the big data block I got:
Mode 1 2 3 4 5 6
Symmetry: 1 B1G 1 E2U 1 E2U 1 B2U 1 E2G 1 E2G
mu 504.72215 550.38168 550.38333 579.74361 673.09113 673.11267
l( 1x) -0.00000 0.00004 -0.00002 -0.35218 0.26965 -0.40252
l( 1y) -0.00001 -0.00002 0.00001 0.20647 0.01705 0.31354
l( 1z) -0.40826 -0.09727 -0.56909 0.00003 -0.00000 -0.00000
l( 2x) 0.00001 -0.00000 -0.00000 -0.00271 -0.01393 -0.16470
l( 2y) 0.00000 0.00005 -0.00003 -0.40825 0.55016 -0.05782
l( 2z) 0.40825 -0.44422 0.36878 -0.00007 0.00000 0.00001
l( 3x) -0.00000 -0.00004 0.00003 0.35490 -0.34942 -0.34037
l( 3y) 0.00000 -0.00002 0.00002 0.20177 -0.04509 -0.30554
l( 3z) -0.40824 0.54149 0.20032 0.00004 -0.00000 -0.00000
l( 4x) 0.00000 0.00004 -0.00003 -0.35219 -0.26966 0.40251
l( 4y) -0.00001 -0.00003 0.00002 0.20648 -0.01705 -0.31354
l( 4z) 0.40824 -0.09727 -0.56910 0.00004 0.00000 -0.00000
l( 5x) 0.00001 0.00000 -0.00000 -0.00272 0.01394 0.16469
l( 5y) 0.00001 0.00004 -0.00003 -0.40824 -0.55016 0.05781
l( 5z) -0.40825 -0.44421 0.36879 -0.00008 0.00000 0.00001
l( 6x) -0.00001 -0.00003 0.00003 0.35489 0.34941 0.34038
l( 6y) 0.00000 -0.00002 0.00001 0.20177 0.04510 0.30554
l( 6z) 0.40826 0.54148 0.20030 0.00005 -0.00000 -0.00000
Working second column:
Mode 1
Symmetry: 1 B1G
mu 504.72215
l( 1x) -0.00000 |
l( 1y) -0.00001 |first 3 rows
l( 1z) -0.40826 |
l( 2x) 0.00001 *
l( 2y) 0.00000 * second block of rows
l( 2z) 0.40825 *
l( 3x) -0.00000 +
l( 3y) 0.00000 + third block of rows
l( 3z) -0.40824 +
l( 4x) 0.00000 -
l( 4y) -0.00001 - 4
l( 4z) 0.40824 -
l( 5x) 0.00001 /
l( 5y) 0.00001 / 5
l( 5z) -0.40825 /
l( 6x) -0.00001 #
l( 6y) 0.00000 # 6
l( 6z) 0.40826 #
There is in the second column a small data blocks. I need to order it in the next way:
-0.00000 -0.00001 -0.40826 <-- elements in first 3 rows
0.00001 0.00000 0.40825 <-- Elements in second block of rows
-0.00000 0.00000 -0.40824 <---elements in 4
0.00000 -0.00001 0.40824
0.00001 0.00001 -0.40825
-0.00001 0.00000 0.40826
The last process is used to the next columns (3-7).
All elements in the third colum need to be added to the end of last small block in the same way that was order in the last problem.
So at the end I will get 6 small data blocks with a blank line between those.
Can anybody help me?
Thnaks in advance