MBX-users

1–8 of 8

Welcome to the MBX users group! Feel free to post and ask about any issue or question of the MBX software package. Please see if your question has already been answered in previous posts.

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Julius Oppenheim, Marc Riera7

Jan 30

Error linking MBX to i-PI

Hello Julius, I-pi did indeed run correctly. The "error" message will always appear, since

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Error linking MBX to i-PI

Hello Julius, I-pi did indeed run correctly. The "error" message will always appear, since

Jan 30

davide Moscato, … Marc Riera5

Jan 30

Hello Davide, You don't need to worry about that. MBX takes care of PBC properly. You can pass

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Hello Davide, You don't need to worry about that. MBX takes care of PBC properly. You can pass

Jan 30

Sagi Meir, Marc Riera11

Jan 19

Error in compiling MBX in lammps

Hello! We finally figured out the problem(s). 1) One needs to make sure that MBX and LAMMPS are

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Error in compiling MBX in lammps

Hello! We finally figured out the problem(s). 1) One needs to make sure that MBX and LAMMPS are

Jan 19

Jack Huang, Marc Riera5

10/20/22

Errors occurred when run some of the examples

That sounds about right. The polynomial files are huge and they require a lot of memory if compiled

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Errors occurred when run some of the examples

That sounds about right. The polynomial files are huge and they require a lot of memory if compiled

10/20/22

Francisco Guzman, … Marc Riera11

8/9/22

Compile, MBX, fails at make check

Hello! It is indeed a mistery. If the serial tests are passing, then everything is fine. The

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Compile, MBX, fails at make check

Hello! It is indeed a mistery. If the serial tests are passing, then everything is fine. The

8/9/22

Young In Jhon, Marc Riera2

8/2/22

questions on MB-pol/MB-nrg

Hello, I insert answers: On Tuesday, August 2, 2022 at 10:13:42 AM UTC-4 Young In Jhon wrote: Hello?

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questions on MB-pol/MB-nrg

Hello, I insert answers: On Tuesday, August 2, 2022 at 10:13:42 AM UTC-4 Young In Jhon wrote: Hello?

8/2/22

6/3/22

Meaning of the max_n_eval_Xb

Question asked by other means: Hello, Thanks for the nice program! it is not mentioned in the README,

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Meaning of the max_n_eval_Xb

Question asked by other means: Hello, Thanks for the nice program! it is not mentioned in the README,

6/3/22

5/25/22

Hello! This is the very first message (and ice breaker conversation) for the MBX-users group! Please

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Hello! This is the very first message (and ice breaker conversation) for the MBX-users group! Please

5/25/22

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