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About the Science Talk category
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1
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378
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June 7, 2021
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Frontiers in Computational Chemistry, Oct 7 2022
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0
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20
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August 9, 2022
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How DFT-D3 affects 3-d vs. layered structures
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0
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28
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July 11, 2022
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Materials Studio, Charges
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2
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44
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June 22, 2022
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Molecular modeling of diatomic molecules
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4
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47
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June 14, 2022
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Force field
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1
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59
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May 30, 2022
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Change xyz coordinates
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0
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46
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May 24, 2022
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Introduce Carolina Materials Database
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1
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141
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April 18, 2022
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I want to use one of the potentials on NIST , but how can I implement them like Al-Au-Si
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2
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155
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March 2, 2022
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X- Ray diffraction
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1
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105
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February 10, 2022
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The comparison of bandgap value of slab and bulk phase
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1
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130
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February 8, 2022
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Managing Research Software Projects Workshop
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0
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143
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September 8, 2021
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How best to post FYI of upcoming conferences?
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2
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182
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May 14, 2021
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Asking something about CP2K
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0
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208
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April 22, 2021
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How do people handle uncertainty in simulation/experimental data for a model?
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0
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196
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March 31, 2021
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Outage Log
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1
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253
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February 18, 2021
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DFT calculation on Sn and/or SnOx
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0
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186
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December 2, 2020
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Hello, everyone i m new here. And i m trying to make a input file for CnZn cluster , and i m stucked while making it. So, can anyone help me?Thanks in advanced
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0
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221
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October 14, 2020
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Alter stoichiometry of existing compounds/recalculate
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2
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237
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September 22, 2020
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DFT Charge density vs FTIR analysis
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0
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422
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September 20, 2020
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Wrong projection of wannier functions
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2
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285
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September 8, 2020
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VASP DOS calculations for metal Hexacyanoferrates
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8
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808
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August 28, 2020
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Materials Science Community Forum Charter
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1
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288
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August 26, 2020
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ML in predicting the starting composition
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7
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395
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June 30, 2020
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Questions force field for silica crystal
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0
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308
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May 28, 2020
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Notice: change of url to just "matsci.org" and project shortcuts
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0
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317
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May 6, 2020
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Create 3D model of crystal silica
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1
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382
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May 3, 2020
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