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Fvib from fitfc and fitsvsl
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0
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0
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March 20, 2025
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How to accelerate phb calculation?
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5
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1
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March 20, 2025
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Question on SQS
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1
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1
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March 20, 2025
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Segmentation Fault (mcsqs)
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0
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0
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March 20, 2025
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Question on constraints
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6
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0
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March 20, 2025
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Maps ground state checking
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4
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3
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March 19, 2025
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ECIs do not decay
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2
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1
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March 19, 2025
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CE truncation depending on -g parameter?
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0
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0
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March 19, 2025
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Computing free energy with emc2
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1
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0
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March 19, 2025
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MCSQS Clusters & using a modified supercell
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1
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0
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March 19, 2025
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Using the CE (ranges and size of structures)
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1
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0
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March 19, 2025
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Si-Ge phase diagram converging point > 450 K
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7
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4
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March 19, 2025
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Conserving Lattice Vectors in MCSQS + best result to choose
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18
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6
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March 19, 2025
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Charge balance issue
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2
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0
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March 19, 2025
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Lat.in for adatom
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1
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0
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March 19, 2025
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fix a number of vacancy site
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1
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0
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March 19, 2025
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Mcsqs for pyrochlore structure
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2
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2
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March 19, 2025
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How to fix some ECI in fitting
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6
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3
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March 19, 2025
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Van de Walle group research featured in Washington Post
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0
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0
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March 19, 2025
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Binary compounds (e.g. Ti3Al) in psuedobinary (Ti,Cr)2AlC PD
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7
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5
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March 19, 2025
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Correlation function
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6
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1
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March 19, 2025
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SQS question
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6
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6
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March 19, 2025
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SQS generation on multiple cores
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6
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3
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March 19, 2025
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KPOINTS automatic generation, not quite commensurate
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2
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2
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March 18, 2025
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Compute phase boundaries betw two different parent lattices
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6
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4
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March 18, 2025
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A question about SQS
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3
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3
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March 18, 2025
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Requesting Tutorial for ATAT
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7
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3
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March 18, 2025
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SQS generation using mcsqs code
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6
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2
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March 16, 2025
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Time for generating supercells in MCSQS
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8
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1
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March 16, 2025
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Can structure relaxation be included in cluster expansion?
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1
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1
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March 16, 2025
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