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| Topic | Replies | Views | Activity | |
|---|---|---|---|---|
| How to run .traj file inside python? |
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2 | 53 | September 24, 2021 |
| How to set pomass for different elements in calc.set()? |
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1 | 23 | September 16, 2021 |
| The meaning of force call in BFGSLinearsearch method |
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2 | 35 | September 16, 2021 |
| Python Package and guide on integrating Fireworks, ASE and VASP. What does your cloud architecture look like? |
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3 | 113 | August 22, 2021 |
| Cell size on adsorption calculations |
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2 | 88 | August 7, 2021 |
| Creating oriented structure in pymatgen |
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0 | 86 | July 23, 2021 |
| Kim calculator problem |
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1 | 118 | July 13, 2021 |
| Error during tests ase tests |
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1 | 96 | June 26, 2021 |
| Alternative to get_cell() ase method for pymatgen |
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1 | 63 | May 9, 2021 |