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OrlandoTrejo (talkcontribs)

kya be chal nhi rha hai!!!

kya be chal nhi rha hai!!!

I tried to run the simulation but its not working!!!

I tried to run the simulation but its not working!!!

what I spupposed to do!!!

what I spupposed to do!!!

its been three decades man!!! I m getting old!!!

its been three decades man!!! I m getting old!!!

ohhhk thanks guys!!!

ohhhk thanks guys!!!

I going to submit it by noon!!!

I going to submit it by noon!!!

Centaure99 (talkcontribs)

Chalega Bhaiya chalega

Chalega Bhaiya chalega

Just wait for few minutes, simulation will start in few minutes

Just wait for few minutes, simulation will start in few minutes

Actually for the first time it takes a little longer to boot the device after that it gets easily booted

Actually for the first time it takes a little longer to boot the device after that it gets easily booted

OrlandoTrejo (talkcontribs)

quantum espresso exploration step-by-step is not opening!

quantum espresso exploration step-by-step is not opening!

Hi yes

Hi yes

Sorry ,You can define use the material in the FDTD Solutions software

Sorry ,You can define use the material in the FDTD Solutions software

This material should be handled manually in the unclear material library

This material should be handled manually in the unclear material library

بله میدونم لایسنس داره

بله میدونم لایسنس داره

Yes, I know you have a license

Yes, I know you have a license

Thankful

Thankful

Centaure99 (talkcontribs)

Please let me know ho we can help?

Please let me know ho we can help?

FDTD Solutions is a licensed software. Do you have a Lumerical license associated on kogence platform.

FDTD Solutions is a licensed software. Do you have a Lumerical license associated on kogence platform.

If yes, I will put you in touch with a Lumerical rep in Kogence and they can help. Please let me know?

If yes, I will put you in touch with a Lumerical rep in Kogence and they can help. Please let me know?

FDTD Plus is an opensource alternative available on Kogence.

FDTD Plus is an opensource alternative available on Kogence.

yes

yes

I am facing issue in login

I am facing issue in login

using facebook

using facebook

BanseeDatta (talkcontribs)

Nothing that important (only 4 credits) I can always just rerun it, it's fine for you to do a reboot

Nothing that important (only 4 credits) I can always just rerun it, it's fine for you to do a reboot

Centaure99 (talkcontribs)

can you stop your job so database state is not messed up.

can you stop your job so database state is not messed up.

Testteam13579 (talkcontribs)

How do I visualise my simulation?

How do I visualise my simulation?

can u see my screen?

can u see my screen?

Visualization challenge LAMMPS K

Visualization challenge LAMMPS K

I have run the simulation

I have run the simulation

and am trying to visualise it

and am trying to visualise it

No

No

pwd

pwd

pwd

pwd

Can't work this out?

Can't work this out?

Im trying to do pwd in the terminal but nothing appears

Im trying to do pwd in the terminal but nothing appears

yes

yes

ok

ok

then?

then?

the permissions tab is locks

the permissions tab is locks

locked

locked

i can't edit the permissions

i can't edit the permissions

yes

yes

Im doing it again

Im doing it again

ok on windows?

ok on windows?

ok brilliant

ok brilliant

thanks for that

thanks for that

i can't see this

i can't see this

It ran for like 5 minutes

It ran for like 5 minutes

then it said i can visualise it

then it said i can visualise it

ok

ok

I will give it another go

I will give it another go

Do i enter this command in the terminal in the visualise tab?

Do i enter this command in the terminal in the visualise tab?

do i create this file?

do i create this file?

yes

yes

i don't have this file

i don't have this file

the input file

the input file

the examples

the examples

Visualization Challenge QE

Visualization Challenge QE

no

no

Quantum

Quantum

Visualization Challenge QE

Visualization Challenge QE

___titusiError Jan 16, 2018, 8:33:35 PM ___titusiOutput Jan 16, 2018, 8:33:34 PM new_test.sh Jan 16, 2018, 8:33:29 PM scf_slab.in Jan 16, 2018, 8:33:29 PM scf_slab.out Jan 16, 2018, 8:33:34 PM spin_d_3D Jan 16, 2018, 8:33:29 PM spin_d_3D.cube Jan 16, 2018, 8:33:35 PM tcne_mn.cube Jan 16, 2018, 8:33:32 PM tcne_mn.in

___titusiError Jan 16, 2018, 8:33:35 PM ___titusiOutput Jan 16, 2018, 8:33:34 PM new_test.sh Jan 16, 2018, 8:33:29 PM scf_slab.in Jan 16, 2018, 8:33:29 PM scf_slab.out Jan 16, 2018, 8:33:34 PM spin_d_3D Jan 16, 2018, 8:33:29 PM spin_d_3D.cube Jan 16, 2018, 8:33:35 PM tcne_mn.cube Jan 16, 2018, 8:33:32 PM tcne_mn.in

its not loading the file

its not loading the file

Just keeps saying getting file

Just keeps saying getting file

ok

ok

its still not opened

its still not opened

did u do this by editing the .cube file?

did u do this by editing the .cube file?

ok

ok

simulation was submitted

simulation was submitted

i guess i need to wait 2 hours

i guess i need to wait 2 hours

...

...

visualise window so slow too

visualise window so slow too

so i can download the data from the cloud and then run the visualiser on my laptop?

so i can download the data from the cloud and then run the visualiser on my laptop?

brilliant

brilliant

I got to dash off now

I got to dash off now

thank you for all your help gauss

thank you for all your help gauss

Centaure99 (talkcontribs)

what simulation you are trying to run?

what simulation you are trying to run?

ok I can guide through, you need to use VMD .. are you familiar with VMD

ok I can guide through, you need to use VMD .. are you familiar with VMD

ok let me help you , what is your work directory name ?

ok let me help you , what is your work directory name ?

ok are you in the browser,

ok are you in the browser,

click on collaborate

click on collaborate

now add shruba@gmail.com .. so I can go to your directory, you can see a blue and white + sign use it to add me

now add shruba@gmail.com .. so I can go to your directory, you can see a blue and white + sign use it to add me

have you copied the original directory ?

have you copied the original directory ?

ok

ok

for practice , you can download vmd in your laptop and practice too

for practice , you can download vmd in your laptop and practice too

http://www.ks.uiuc.edu/Research/vmd/

http://www.ks.uiuc.edu/Research/vmd/

yes, its free

yes, its free

use the dump.lampstraj file to view

use the dump.lampstraj file to view

ok how long you ran your simulation?

ok how long you ran your simulation?

ok then you cant see, to generate file you need to run bit longer

ok then you cant see, to generate file you need to run bit longer

for new lammpstraj

for new lammpstraj

ok let me give you a tips

ok let me give you a tips

following command generates your visualization

following command generates your visualization

dump TRAJ all custom 2000 dump.lammpstrj id mol type element x y z ix iy iz dump_modify TRAJ element C H O H

dump TRAJ all custom 2000 dump.lammpstrj id mol type element x y z ix iy iz dump_modify TRAJ element C H O H

now this 2000 is the snapshot taken in each step...

now this 2000 is the snapshot taken in each step...

at end you see run 200000

at end you see run 200000

now after your run complete you suppose to see 200000/2000 snapshot

now after your run complete you suppose to see 200000/2000 snapshot

no no

no no

it is in your input

it is in your input

open your input in_fep10.lmp

open your input in_fep10.lmp

no you copied your visualization from our file right?

no you copied your visualization from our file right?

from which directory you copied?

from which directory you copied?

no copy this directory "Visualization challenge LAMMPS"

no copy this directory "Visualization challenge LAMMPS"

name "Visualization challenge LAMMPS_with your name"

name "Visualization challenge LAMMPS_with your name"

ok .. so you are not running lammps?

ok .. so you are not running lammps?

but anyway you said lammps earlier

but anyway you said lammps earlier

anyway for quantum espresso what files you see

anyway for quantum espresso what files you see

ok use tcne_mn.cube ... to visulaize

ok use tcne_mn.cube ... to visulaize

you can use vesta

you can use vesta

or vmd

or vmd

if you never use any of them .. I suggest to do some practice with vesta and vmd

if you never use any of them .. I suggest to do some practice with vesta and vmd

https://www.youtube.com/watch?v=6QwLsHxh2IA&t=1459s

https://www.youtube.com/watch?v=6QwLsHxh2IA&t=1459s

its bit heavy wait

its bit heavy wait

I can see your file

I can see your file

I fixed it .. now go .. to your directory submit run

I fixed it .. now go .. to your directory submit run

no .. i edit the software you suppose to use

no .. i edit the software you suppose to use

no no ..

no no ..

go to visualize

go to visualize

red one

red one

yeh

yeh

download the cube file

download the cube file

and http://jp-minerals.org/vesta/en/download.html

and http://jp-minerals.org/vesta/en/download.html

this is vesta..

this is vesta..

and check this video tutorial

and check this video tutorial

https://www.youtube.com/watch?v=6QwLsHxh2IA&t=1459s

https://www.youtube.com/watch?v=6QwLsHxh2IA&t=1459s

I suggest you to do a practice in your laptop first

I suggest you to do a practice in your laptop first

yes

yes

download from your directory

download from your directory

right click .. you find download

right click .. you find download

no problem

no problem

Ericng (talkcontribs)

Why is this happening?

Ericng (talkcontribs)

Can anyone help to look into this?

Simulation run #6466 or #6464.

I suspect it is due to some model settings causing the instance to hang or not running.