Matter Modeling Beta
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Anoop A Nair

I'm an Integrated-Masters Student in physics. My main interests involve coding, machine learning, materials modelling and Inventing things.

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17 High-Performance Computing: What does “Mio CPUh” mean? Nov 10 '20
12 Are there any codes to study magnetic materials? Nov 8 '20
11 When should “vc-relax” be performed over “relax” calculations in Quantum ESPRESSO? Sep 23 '20
11 When should spin polarized calculations be done? Sep 20 '20
11 What are good resources to learn to code for matter modeling? Nov 4 '20
10 Is it possible to calculate the Curie temperature for magnetic systems? Dec 7 '20
10 Should I do vc-relax with nspin=2 in Quantum Espresso for magnetic samples? Oct 1 '20
10 How can I prove that a material is ferroelectric using DFT? Dec 29 '20
9 Is the “Final Magnetic moment” in the materials project repository same as the “total magnetization” value in Quantum ESPRESSO output files? Dec 4 '20
9 How can I know if 3D aperiodic systems are not interacting with each other using Quantum ESPRESSO? Jan 17
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