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About the Science Talk category
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1
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773
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June 7, 2021
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Heat capacity of a Lennard-Jones fluid using LAMMPS
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1
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11
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March 10, 2025
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Ti coating effect on diamond In-plane thermal conductivity
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0
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6
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March 6, 2025
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RAFFLE: A Python library for interface structure prediction
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0
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14
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March 6, 2025
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Energy Minimization Discrepancy in Mirrored vs. Distinct Graphene–Water Systems
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1
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12
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February 22, 2025
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Solvation Free Energy of methane in TIP4P/2005f
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6
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35
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February 18, 2025
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Comparing LAMMPS and GROMACS
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5
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44
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February 12, 2025
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Determining the Equilibrium Distance in Polymer Modelling
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2
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15
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February 9, 2025
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Are there (inter)national initiatives regarding Trump's election in the material science communities? What is the situation of the forum?
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0
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20
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February 9, 2025
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How do I estimate the leakage of single-pane windows?
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1
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14
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January 29, 2025
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Strengthening cellophane - types 165 and 180 - while keeping clear and flexible
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3
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21
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January 23, 2025
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Open PhD position in the CIMAP laboratory, France
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0
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48
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January 17, 2025
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Help Needed with Computing Global Pressure and Stress Tensor from LAMMPS Dump File
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2
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53
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January 13, 2025
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Heterogeneous Nucleation of Ice on Carbon Surfaces
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4
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40
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January 5, 2025
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How to control pressure under fixed boundary conditions
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2
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33
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January 1, 2025
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Strain rate amount problem
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1
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17
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January 1, 2025
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How to use RMSD trajectory calculator in VMD?
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0
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8
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December 20, 2024
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EAM Potential Parameterization for LAMMPS Simulation
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1
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45
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December 19, 2024
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Generating GAFF for Conformational Polymorphs
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1
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28
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November 27, 2024
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Energy-Volume minimum of water does not match zero pressure
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7
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97
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November 15, 2024
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Which Software? Light Scattering of Molecules
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0
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12
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November 11, 2024
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How to identify the different local chemical environment for different facets?
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0
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12
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November 10, 2024
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Can the bond/angle parameters obtained from DFT scanning be directly used for MD simulations?
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3
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44
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November 8, 2024
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Equilibrating cellulose crytal to a realistic density with charmm36 force field
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1
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19
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November 7, 2024
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On the current state of molecular simulation softwares and teaching
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9
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200
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November 7, 2024
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10 open PhD Positions in Max Planck Research School SusMet
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0
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33
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October 7, 2024
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How to do equilibration or observe it in Monte Carlo MD using NPT ensemble?
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1
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25
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September 26, 2024
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High strain rate problems in molecular dynamics simulations
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1
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26
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September 13, 2024
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Inquiry about setting up a server for DFT calculation in the lab
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7
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111
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September 9, 2024
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PMF profile for polymer
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2
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30
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September 4, 2024
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