USPEX

Dear USPEX Team, I have a question regarding the symmetry of the structure as reported in the '

Which e-mail did you use for registration? On Tuesday, May 20, 2025 at 3:30:58 PM UTC+3 awees...@

Hi colleagues, Any ideas how to solve this problem? Thanks! Vladimir. On Sunday, June 8, 2025 at 9:46

Hi, I'm interested in the finite temperature structure search method named T-USPEX talked in this

Here is an .xyz file of CO2: ====================== 3 CO2 C 0.000 0.000 0.000 O 0.000 0.000 1.180 O

actually this fix is useless the uspex contains binary python libraries which only provide py36-py39

Dear USPEX Developers, I would like to perform a simulation of crystal phase transitions using the

Dear Users, Did the problem solved already? I see the same now for 10.5 version. Sincerely, Hayk On

Hi, I am not sure about this: Create an env: "python3.10 -m venv uspex_env" I installed the

Same problem. Has anyone solved this? On Thursday, April 17, 2025 at 5:31:20 AM UTC+3 amand...@gmail.

Hello, I am trying to login to my USPEX account but it says wrong password, yet I have used the

Hello USPEX Forum. I've prepared the INPUT.txt file and executed the command "USPEX -g"

Dear Team, When trying to run VCNEB calculation the following error occurs: *************************

The registration problem is fixed now. Please, check it! суббота, 8 марта 2025 г. в 11:23:19 UTC+3,

Hi. Try to modify the input file of the EX13 examlpe, instead of generating this input file again. Le

Hi everyone, I'm working on the EX-13 exercise using the Special Quasirandom Structures (SQS)

I have the same problem, so how to fix it On Monday, 21 January 2019 at 17:17:58 UTC+8 PRINCE KUMAR

The calculation under USPEX was successfully completed without errors for predicting the most stable

Hello, I just checked my email now. I am reaching out because I have a few additional questions. I am

I am experiencing the same issue. Did you manage to resolve the problem? 2020년 8월 8일 토요일 오전 5시 54분 3초

Hello, Did you manage to resolve the issue with high energy barrier? My calculations shows a

Hello, I have used pmpaths.py to generate the trajectory between my endpoints, however, the enrgy

Hello, Did you find the right tags to include to restart a VCNEB calculation? Thanks On Monday, June

I am trying to install USPEX in M2 Mac. But currently, it seems that USPEX is available only for

i'm using USPEX TO predict structures starting from a molecule. it runs the crystal predicition

Hi, I am looking into in USPEX for Metal-organic framework (MOF) crystal structure prediction. Is

so i have run the example 33 in uspex 10.5 with cluster 1 and it ran into issues with listed error /

Yes, I have also encountered a similar problem, but my situation is even stranger. When I failed to

Hello, While running USPEX_v10.5, I encountered the following error: ModuleNotFoundError: No module

Hello, videotutorials on the USPEX website in the USPEX Documentation section are unavailable because