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#1
General / Re: MOF structure atoms not sh...
Last post by yuvi01 - September 23, 2026, 01:24:30 PM
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#2
General / Re: Can the cavity of a MOF be...
Last post by ramikaa - September 23, 2026, 11:34:40 AM
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#3
General / Looking for RASPA Users Experi...
Last post by FrancisAMessenger - September 23, 2026, 10:08:11 AM
Hi everyone!

I'm exploring RASPA for molecular simulations and would love to hear from experienced users.

What does your typical RASPA workflow look like, and what output formats do you usually work with? I'd also be interested to know how you validate simulation results and whether iRASPA can be used to run simulations directly.

Any practical examples or advice would be greatly appreciated!

Thank so much!
#4
General / Re: CIF file
Last post by pooja7191 - September 22, 2026, 08:19:04 AM
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#5
General / Adding More Flexibility to the...
Last post by Reutov - September 19, 2026, 04:41:46 PM
One thing I've noticed after using cryptocurrency for a while is that managing digital assets is usually straightforward, but actually using them outside a trading platform can involve several additional steps. I might have crypto available in my account, yet for normal purchases I still rely on completely separate payment methods.

This is where the MEXC Card becomes interesting to me. Rather than changing how I manage my assets, it adds another possible way to access their practical value. When card payments are supported and the relevant conditions are met, the idea is to make the transition from managing crypto to paying for something feel more natural.

I particularly like that this does not have to become my primary payment method. I can keep using traditional cards for most expenses while having a crypto-linked option available when it makes sense. That approach fits my routine better than trying to turn every purchase into a cryptocurrency transaction.

There is also a convenience factor in keeping different crypto activities connected. If I already use MEXC to manage digital assets, having access to a card-related service within that broader environment can reduce the need to rely on completely separate solutions just to explore another use for those assets.

At the same time, I would check the current card terms before applying or planning to use it regularly. Eligibility, verification requirements, supported assets, fees, transaction limits, and service availability can vary by region and may be updated over time.

For me, the appeal is mainly about optionality. Crypto can remain something I hold or trade, but when I want another way to use part of my digital assets, having a familiar card-based payment option makes the overall experience more versatile.
#6
Input files and parameters / Re: British English vs America...
Last post by Jenny11 - September 19, 2026, 09:41:31 AM
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#7
General / Question about setting up adso...
Last post by MargaretJAtwood - September 19, 2026, 03:49:55 AM
Dear RASPA users,

I'm new to RASPA and I'm currently learning how to set up adsorption simulations for porous materials.

I would like to simulate the adsorption of a gas molecule in a zeolite using GCMC. I have prepared the zeolite structure and the adsorbate molecule, but I'm still not completely sure about the appropriate simulation settings, especially the choice of simulation box size and the number of equilibration and production cycles.

For those who have experience with similar systems, what would you recommend as a reasonable starting point for these parameters? Are there any common mistakes that beginners should avoid when setting up a GCMC simulation in RASPA?

Any advice or example input files would be greatly appreciated.

Thanks in advance for your help.

Best regards,
Margaret J. Atwood
#8
General / Re: CIF file
Last post by pooja7191 - September 14, 2026, 11:30:47 AM
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#9
General / Re: Why Is Trust Important Whe...
Last post by yuvi01 - September 12, 2026, 02:57:20 PM
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#10
General / Re: The preprocessor macro `ST...
Last post by Jenny11 - September 12, 2026, 09:56:17 AM
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