Commit 3b73c5aa authored by Micael Oliveira's avatar Micael Oliveira Committed by Mohamed, Fawzi Roberto (fawzi)

Keeping the list in alphabetical order.

parent 777923f7
......@@ -1667,6 +1667,19 @@
"superNames": [
"section_k_band_normalized"
]
}, {
"description": "Holds the lattice vectors (in Cartesian coordinates) of the simulation cell. The last (fastest) index runs over the $x,y,z$ Cartesian coordinates, and the first index runs over the 3 lattice vectors.",
"dtypeStr": "f",
"name": "lattice_vectors",
"repeats": false,
"shape": [
3,
3
],
"superNames": [
"configuration_core"
],
"units": "m"
}, {
"description": "An array of the dimension of number_of_atoms where each atom (identified by the index in the array) is assigned to an atom-centered basis set, for this section_single_configuration_calculation. The actual definition of the atom-centered basis set is in the section_basis_set_atom_centered that is referred to by this metadata.",
"dtypeStr": "r",
......@@ -2839,19 +2852,6 @@
"superNames": [
"section_method"
]
}, {
"description": "Holds the lattice vectors (in Cartesian coordinates) of the simulation cell. The last (fastest) index runs over the $x,y,z$ Cartesian coordinates, and the first index runs over the 3 lattice vectors.",
"dtypeStr": "f",
"name": "lattice_vectors",
"repeats": false,
"shape": [
3,
3
],
"superNames": [
"configuration_core"
],
"units": "m"
}, {
"description": "Determines whether a *single configuration calculation* in section_single_configuration_calculation is converged.",
"dtypeStr": "b",
......
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