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Protein simulating
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0
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204
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August 6, 2023
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Job opening in VMD (Visual Molecular Dynamics) development team
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0
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277
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August 2, 2023
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MXene dataset
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2
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427
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July 7, 2023
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Open Ph.D. Position (starting Fall 2023) in computational materials research (molecular dynamics, organic-inorganic interactions)
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0
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330
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July 6, 2023
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Validated NORM-CONSERVING pseudopotential for HSE
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0
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238
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June 28, 2023
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Suitable material for non-corroding grill surface
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0
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285
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June 19, 2023
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Pourbaix Digram using DFT
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0
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253
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June 15, 2023
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Viscosity or damp factor of langevin
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0
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221
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May 25, 2023
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Discussion: Workflow and data provenance for atomistic simulations
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5
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858
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October 25, 2022
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Simulation of saltwater droplet on a surface
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4
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315
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April 24, 2023
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Fine-tuning CHGNet with AIMD data
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3
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1121
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April 18, 2023
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Suggestion for experimental data schemas
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0
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277
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April 18, 2023
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Need help for calculating the interatomic energy between two Au atoms using Auu3.eam potential file
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1
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271
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April 1, 2023
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Thermal conductivity
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0
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305
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March 22, 2023
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Open ended Senior Software Scientist position available (UK)
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0
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293
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March 14, 2023
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Phase transformation for si gas hydrates
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0
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275
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January 25, 2023
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ML predictions not correlated with bias in data
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0
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300
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January 22, 2023
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How can I understand My structure is Amorphous or not?
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1
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305
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January 18, 2023
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Influence of one region over other inspite of gap between atoms
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1
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264
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December 27, 2022
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Fresh raspberries repel honey (?)
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2
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554
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December 13, 2022
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VMD -> OpenGL-display does not work on Xforwarding
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0
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396
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December 12, 2022
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Hiring Ph.D. students for my group at Northeastern University
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0
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355
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December 8, 2022
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Difference of thermal conductivity along different axis
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0
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287
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December 2, 2022
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General notice: Mastodon server
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0
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330
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November 29, 2022
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Gas Hydrate Melting point
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2
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420
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October 31, 2022
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How do I define the density of a finite system?
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2
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327
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October 31, 2022
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Introduce Carolina Materials Database
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2
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596
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October 29, 2022
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Force field
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2
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457
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October 10, 2022
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FAIR principles for molecular dynamics
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1
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532
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September 29, 2022
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Frontiers in Computational Chemistry, Oct 7 2022
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0
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386
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August 9, 2022
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