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What is the velocity unit for atoms object?
|
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2
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29
|
January 11, 2022
|
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What is the principle of generating INCAR tags in ASE?
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0
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29
|
January 5, 2022
|
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Implemeting SciPY from pymatgen output
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1
|
45
|
December 13, 2021
|
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ASE convesion of Trajectory file to XDATCAR
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0
|
40
|
December 8, 2021
|
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OpenKim Model Drivers to utilize Neural Network Potentials in ASE
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7
|
121
|
November 23, 2021
|
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How to run .traj file inside python?
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2
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109
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September 24, 2021
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How to set pomass for different elements in calc.set()?
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1
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50
|
September 16, 2021
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The meaning of force call in BFGSLinearsearch method
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2
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81
|
September 16, 2021
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Python Package and guide on integrating Fireworks, ASE and VASP. What does your cloud architecture look like?
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3
|
172
|
August 22, 2021
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Cell size on adsorption calculations
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2
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126
|
August 7, 2021
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Creating oriented structure in pymatgen
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0
|
125
|
July 23, 2021
|
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Kim calculator problem
|
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1
|
167
|
July 13, 2021
|
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Error during tests ase tests
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1
|
195
|
June 26, 2021
|
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Alternative to get_cell() ase method for pymatgen
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1
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95
|
May 9, 2021
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