USPEX

Hi all, Is it possible to predict van der waal heterostructures using USPEX code? Thanks and regards

Dear all, I registered at the USPEX website so I could download the package. After registration I did

Dear all I am facing problem in installing USPEX software on windows. I've downloaded the USPEX

Dear all, I am running USPEX, but I am getting an error after the first structure is done: Command

Sorry, it is not 5, it should be 10. I want the 10 parallel VASP tasks submitted by USPEX to run

The issue is resolved: The problem was in the input.uspex, that has changed between the USPEX

Hi, I'm using USPEX to run LAMMPS and CP2K for searching surface I know here is the discussion

Dear Administrator, I am a PhD student studying polymer crystals at ICCAS. We have tried some

Hii users, I want to run example 13 (EX13-3D_special_quasirandom_structure_TiCoO) with abinit input

Dear all, I am new to USPEX and I would like to have a clarification. Will the python version the

I just received the error below on running. Then reinstalled and done all the steps at the

You should register on the uspex-team.org to get an access to the latest versions of USPEX code. The

You have a relatively small fraction of initial random symmetry structures. Possibly these structures

Have you installed all necessary dependencies (python packages) pointed out in PREREQUISITES section

You should adjust numParallelCalcs parameter. On Wednesday, March 15, 2023 at 5:28:13 AM UTC+3 d1597.

If the optType variable in your INPUT.txt is equal to 1, the stability is totally based on the

I am using USPEX code with Abinit software. I have installed USPEX successfully but I have not seen

Dear All, I'm trying to run "EX02-3D_MgAl2O4_gulp" in the examples with VASP. I didn

Hi all.. I am using USPEX10.5 and trying to calculate phase transformation through VCNEB. My test

I am using USPEX2022.1 & GULP to predict the crystal structure of organic molecules. After

Dear Administrator: When I was running USPEX, I hoped to generate 30 individuals per generation, but

Dear Administrator: When I am running USPEX, I hope to generate 30 individuals per generation, but

Dear all, I'm trying to run USPEX v.2022.1 in our cluster, which is managed by the torque (PBS)

Hi, I am trying to optimize a molecular crystal using the following input: * TYPE OF RUN AND SYSTEM *

Hi, did you manage to solve the problem? Seems like I am having the same issue. For a molecular

Hello Everyone, I'm attempting to run USPEX on our cluster. I installed USPEX_2022.0.1 using pip

Dear developers and users, I am now trying to set up a workflow to predict the crystal structure of

Dear Pavel, Thank you very much for your suggestion. You are right. I had missed the Tersoff

have solved On Thursday, January 19, 2023 at 6:09:58 PM UTC-5 Jian Xu wrote: Dear all, I am wondering

Dear all, I was wondering if it was possible to use the fragment features for non-molecular crystal