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Robert explained in an off-list message how to load PDB's using Jmol.
kinow updated
10 years ago
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When attempting to set number densities or temperatures using binary files on very large grids ((47495 x 6447) cells on (256 x 32) processors), EPOCH2D fails to correctly read the files on ranks with …
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reported by: @CloudyLex
```
Title:
Spectroscopic diagnostics of low-ionized iron-peak elements. Electron-impact excitation of Ni3+ and
photoionization of Ni2+
Authors:
Fernández-Menchero, L.; Sm…
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References are possibly at every page's last in some articles,which grobid can't analyze well.
such as this article: # Spin Density Waves in an Electron Gas
....than 2g. This minimum thermal gap m…
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OPTIMADE specification v1.0.1 defines a structure as a set of sites, occupied by mixtures of atoms, with each atom described by its chemical type, mass and occupancy (proportion in the mixture). Means…
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In this measurement we need to add the following:
- absorptance:
- A = 1 - T - R
- bandgap: from the inflection point of the absorptance
- absorption_coefficient: if the thickness (_d_) is a…
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I need to add a new filed to the stars : StellarParticleType(hdf5) : stellar_particle_type(swiftsimio).
I added the field in:
`particle_fields.py`
```
stars = {
"BirthDensity": "birth_den…
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Data-binding has to be improved before, so that the elements.json JSON file does not have to be fetched repeatedly (even though it is cached - not elegant).
I am possibly thinking IndexedDB. This wou…
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Are meta-GGA functionals from LibXC compatible with SOC calculations in JDFTx?