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Help Regarding ATAT SQS Learning
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0
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7
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March 30, 2025
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MCSQS Query VASP
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5
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9
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March 30, 2025
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Symmetrization of stiffness tensor
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0
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2
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March 30, 2025
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Theoretical calculations
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0
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4
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March 30, 2025
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Problem installing ATAT on Ubuntu
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3
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10
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March 30, 2025
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How to convert POSCAR to str.out (w/o other files existed)
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3
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13
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March 30, 2025
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Figure of merit to identify the best bestsqs
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1
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5
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March 30, 2025
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Canonical Monte Carlo
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0
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5
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March 30, 2025
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Partial cluster expansion
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0
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3
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March 30, 2025
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mmaps is stalled out
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0
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5
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March 30, 2025
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Manually controlling cluster expansion
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0
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0
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March 30, 2025
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vasp.wrap for LDA+U
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0
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1
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March 30, 2025
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interface VASP using queue system
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2
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3
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March 30, 2025
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Problem in linking machine
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5
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6
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March 30, 2025
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How to interpret empty site ECI
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1
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3
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March 30, 2025
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A question on perform runstruct_vasp
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2
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3
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March 30, 2025
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HELP - Usage of genstr
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0
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4
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March 30, 2025
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APB sampling using the mc flags
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0
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2
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March 30, 2025
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Chemical potential set and free energy shift in MC
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0
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4
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March 30, 2025
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Problems with B2 and SQS
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4
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9
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March 30, 2025
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Pair correlation functions calculation
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0
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4
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March 30, 2025
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Optimize structure for a specific concentration only?
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7
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3
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March 30, 2025
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Relaxation convergence of the structures
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0
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2
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March 30, 2025
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Cluster expansion including defect
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0
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3
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March 30, 2025
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How to write lat.in file for metals with different lattices
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0
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7
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March 30, 2025
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SQS generation using mcsqs code
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2
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12
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March 30, 2025
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How do we get a cluster expansion for cubic perovskite
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0
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3
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March 30, 2025
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About the question mark in predstr.out
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1
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2
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March 30, 2025
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Memc2 output so many points with same composition and free e
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0
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8
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March 30, 2025
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Not acheave convergence for generating phase diagram
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0
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1
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March 30, 2025
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