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Stiffness vs Bond length curve
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1
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16
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July 16, 2025
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Memory corruption error while running fitfc
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6
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40
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July 10, 2025
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Phase Diagram Calculation using Phb command
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0
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18
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July 10, 2025
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Quenstion on the concentration of atoms in rndstr.in
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1
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29
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July 2, 2025
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mcsqs finishes immediately and returns only one structure for YSZ fluorite model
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0
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17
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June 18, 2025
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Objective function stagnates (mcsqs)
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2
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40
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June 17, 2025
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Interactive online interface for creating input files for generation of SQS in ATAT mcsqs
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1
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47
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June 16, 2025
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mmaps queries
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0
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16
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June 16, 2025
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Intallation error
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7
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61
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June 10, 2025
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SQS mcsqs 2D monolayer alloy question
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1
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34
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June 9, 2025
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ATAT website now hosted on Github
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0
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43
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June 9, 2025
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Counseling on the output contents of the memc2 command
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3
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30
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May 17, 2025
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Relaxed structures (CONTCAR) to fit to cluster expansion instead of unrelaxed (POSCAR) structure
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1
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20
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May 16, 2025
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Unstable modes in fitfc
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3
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34
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May 1, 2025
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genstr with symm. equivalent structure
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1
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14
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April 30, 2025
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ATAT mcsqs (Segmentation fault (core dumped))
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1
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48
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April 30, 2025
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Is it Expected for Output Structure to Deviate from FCC Seed Framework When Using
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1
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9
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April 30, 2025
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Error in trying out MCSQS
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3
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47
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April 27, 2025
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Short-range order correction in sqs2tdb
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1
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31
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April 19, 2025
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SQS Generation for HCP TiAlV Alloy and DFT Convergence Issues
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1
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41
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April 16, 2025
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Generating SQS for a Ternary HCP Alloy (A-90%, B-6%, C-4%) with Extreme Concentration Skew
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0
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21
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April 14, 2025
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Help with defining fcc cell of In0.52Ga0.48As
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1
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25
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April 10, 2025
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Issue with sqs2tdb -fit in ATAT for Complex Lattices
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2
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29
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April 9, 2025
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mcsqs-Unable to open random structure file
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3
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28
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April 2, 2025
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How to get the rndstr.in about C14 laves structure
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1
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23
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April 2, 2025
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Empty str.out and wait files from sqs2tdb (WSL-Ubuntu)
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1
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12
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April 2, 2025
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why
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1
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27
|
April 2, 2025
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MCSQS Example
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1
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43
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April 2, 2025
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how to run mcsqs
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1
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25
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April 2, 2025
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How to accelerate mcsqs?
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1
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25
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April 2, 2025
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