Commit 402ca32f authored by Henning Glawe's avatar Henning Glawe
Browse files

QE: add metaInfo for cell mass in MD/relax simulations

parent 950ecf5b
......@@ -654,6 +654,15 @@
"section_method"
]
},
{
"description": "Mass of cell in MD/relax calculation",
"name": "x_qe_md_cell_mass",
"dtypeStr": "f",
"shape": [],
"superNames": [
"section_system"
]
},
{
"description": "Finite E-field: direction",
"name": "x_qe_berry_efield_direction",
......
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