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Hello. I am a student working on molecular dynamics. For my master’s project, I want to simulate an epoxy resin. To do this, I tried to create an EPON–DETDA resin using ASE, and then introduce a CNT in the middle of the system. Now, I would like some help
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24
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get ionic temperature and electronic temperature in ttm
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2
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531
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0
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161
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0
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287
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315
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Ask for help
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0
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394
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678
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PDRA @ Queen Mary University London,
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375
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391
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0
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758
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April 20, 2022
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name in process list
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411
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Simulation aborted due to Fortran runtime error
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1
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406
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0
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562
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1
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535
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2
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469
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November 1, 2021
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3
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420
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October 19, 2021
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2
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602
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5
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410
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the simulation of models with oxygen vacancies
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3
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438
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September 22, 2021
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344
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393
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1
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460
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4
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845
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353
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359
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457
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0
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433
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2
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513
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8
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529
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