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Public Attributes | List of all members
q3::StressTensorTotal Struct Reference

#include <contributions.hpp>

Public Attributes

Real pressure = 0.0
 
Real values [3][3] {}
 

Detailed Description

StressTensorTotal — assembled stress tensor (kbar).

Plain data holder returned by compute_stress() alongside StressTensorContributions. Values are in kbar (converted from Ry/bohr³ inside assemble_total_stress_and_log()).

Definition at line 27 of file contributions.hpp.

Member Data Documentation

◆ pressure

Real q3::StressTensorTotal::pressure = 0.0

Definition at line 29 of file contributions.hpp.

Referenced by q3::assemble_total_stress_and_log(), and q3::SelfConsistentFieldFlavor::record_stress().

◆ values

Real q3::StressTensorTotal::values[3][3] {}

Definition at line 28 of file contributions.hpp.

Referenced by q3::assemble_total_stress_and_log(), and q3::SelfConsistentFieldFlavor::record_stress().

The documentation for this struct was generated from the following file: