Re: [SIESTA-L] Test shows "DIFFERENCE FOUND"

2019-03-14 Por tôpico Andrés Lizano Villalobos
Hi again, checking the results from the test I found some of them to be big. Once again I ask the same as above. Is this caused by something in the way I compile the program. Any clue will be appreciated. The compilation flags can be found at the top. Thank you very much. El mar., 26 feb. 2019 a

Re: [SIESTA-L] Test shows "DIFFERENCE FOUND"

2019-02-27 Por tôpico Andrés Lizano Villalobos
I see, I'll check them. Thank you very much. Andrés Lizano Villalobos El mar., 26 feb. 2019 15:03, Nick Papior escribió: > Many of them *should* be very small. There are floating point round-off > errors which makes it very hard to reproduce exactly the same numbers. > So you should look at whi

Re: [SIESTA-L] Test shows "DIFFERENCE FOUND"

2019-02-26 Por tôpico Nick Papior
Many of them *should* be very small. There are floating point round-off errors which makes it very hard to reproduce exactly the same numbers. So you should look at which quantities are un-equal, and if they are, are they within a respectable difference. Den man. 25. feb. 2019 kl. 22.03 skrev Andr

[SIESTA-L] Test shows "DIFFERENCE FOUND"

2019-02-25 Por tôpico Andrés Lizano Villalobos
Dear Siesta users, I've compiled siesta using the arch.make file shown at the end of this message. When I ran the test available all of them show difference respect to the reference outputs in the Reference directory. Some of this appears to be small. I'll appreciate if someone can tell if this pr