{% extends "layout.html" %}
{% set d = s.dct %}
{% block title %}Summary{% endblock %}
{% block bar1 %}
SUMMARY
{% endblock %}
{% block content %}
Download:
xyz,
db,
json
{% if d.numbers|length %}
{% endif %}
{% for name in s.plots %}

{% endfor %}
name | unit | value |
{% for name, unit, value in s.table %}
{{ name }} |
{{ unit }} |
{{ value|safe }} |
{% endfor %}
Unit cell in Ang:
axis | periodic | x | y | z |
{% for axis in s.cell %}
{{ loop.index }} |
{{ d.pbc[loop.index0] }} |
{% for a in axis %} {{ a }} | {% endfor %}
{% endfor %}
{% if s.key_value_pairs %}
Key-value pairs:
Key | Value |
{% for key, value in s.key_value_pairs %}
{{ key }} | {{ value }} |
{% endfor %}
{% endif %}
{% if s.forces %}
Forces in ev/Ang:
# | symbol | x | y | z |
{% for f in s.forces %}
{{ f[0] }} | {{ f[1] }} |
{{ f[2] }} |
{{ f[3] }} |
{{ f[4] }} |
{% endfor %}
{% endif %}
{% if s.stress %}
Stress tensor (xx, yy, zz, zy, zx, yx) in eV/Ang3:
{{ s.stress }}
{% endif %}
{% if s.dipole %}
Dipole moment in e*Ang: ({{ s.dipole }})
{% endif %}
{% if s.constraints %}
Constraints: {{ s.constraints }}
{% endif %}
{% if s.data %}
Data keys: {{ s.data }}
{% endif %}
{% endblock content %}