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About the Science Talk category
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1
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767
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June 7, 2021
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Generating GAFF for Conformational Polymorphs
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1
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19
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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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81
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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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9
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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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31
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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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14
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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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149
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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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26
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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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23
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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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17
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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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56
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September 9, 2024
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PMF profile for polymer
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2
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26
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September 4, 2024
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Learning how to write parallel programs!
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9
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85
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August 28, 2024
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X-ray scattering intensity for polymer simulation
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7
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61
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August 26, 2024
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Electroneutrality in molecular dynamics simulation
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6
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52
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August 23, 2024
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Calculating Elastic Constants of Epoxy Networks
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1
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64
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July 17, 2024
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Anharmonic crystals
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0
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68
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June 19, 2024
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Creating Glassy-Carbon Structure with MD
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0
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98
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June 1, 2024
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How do you view the recent hot machine learning trend?
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5
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195
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May 16, 2024
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Packing ionic liquids of desirable Molarity in A given simulation box size
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3
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211
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April 30, 2024
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Packing ionic liquids of desirable Molarity in A given simulation box size
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0
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87
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April 29, 2024
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Thermal Conductivity Behaviour with Temperature? Molten Slag Systems
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0
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100
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April 26, 2024
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Materials Informatics Competition! April 22nd - May 6th
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0
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142
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April 9, 2024
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LJ units to SI
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1
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134
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April 2, 2024
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Solidification problem (Phase change is not observed)
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3
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164
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April 1, 2024
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Specific capacitance calculation
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0
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241
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March 2, 2024
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Open Review
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5
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631
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January 18, 2024
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Fitting EAM Potential to Cr-Nb System
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0
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170
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December 7, 2023
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Integral capacitance to energy density
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0
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156
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December 5, 2023
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