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GULP - Input scripts - Clarification
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1
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211
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October 26, 2023
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Unit of gtol ftol xtol
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1
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213
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October 16, 2023
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Pair distribution functions
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1
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196
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October 13, 2023
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How to read DYNAMO setfl format file for EAM potential
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1
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273
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October 11, 2023
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Fit potential
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3
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415
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October 8, 2023
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Matrix inversion failed in EEM/QEq
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4
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338
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October 5, 2023
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Phonon dispersion curve of SLG
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1
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245
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October 5, 2023
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Calculating Bond Lengths
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1
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160
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October 3, 2023
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Bulk Modulus of 0
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4
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246
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October 3, 2023
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Visualization software
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1
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173
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October 2, 2023
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How to convert elastic constants calculated from primitive cell to conventional cell?
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2
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209
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September 30, 2023
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Spring constant value
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7
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259
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September 29, 2023
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Reproduction of published interatomic potentials
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1
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192
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September 29, 2023
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Example67 for thermal conductivity
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5
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507
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September 22, 2023
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Keyword confusion: meaning of coulomb_subtract rmax and ewald realradius
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3
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266
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September 21, 2023
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Warning message saying "Warning - number of modes has changed to xxx ***"
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2
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469
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September 18, 2023
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Problem of gulp parallel in linux
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5
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271
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September 15, 2023
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Phonon calculation with negative frequencies (imaginary models)
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3
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332
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September 11, 2023
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Example 5 of the phonon dispersion
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3
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314
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September 4, 2023
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Tutorial for Beginners
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3
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319
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August 30, 2023
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Precision of phonon eigenvectors
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1
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200
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August 27, 2023
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Specifying vacancies
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1
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193
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August 22, 2023
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CH_PENALTY = ZERO produced by CGenFF forcefield for GULP, why?
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2
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195
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August 18, 2023
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Final defect energy value
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1
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194
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August 18, 2023
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Error when running two instances of gulp simultaneously
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3
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365
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August 18, 2023
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Question about the NEB calculation
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1
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330
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August 16, 2023
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An empty output file when running Examples
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1
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247
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August 16, 2023
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2D and 1D lattice optimization
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1
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200
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August 5, 2023
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Interface calculations
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1
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216
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July 14, 2023
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Fractional coordinates in output of MD run
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2
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270
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July 13, 2023
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