Materials id 18183 / YSnF7 / P2_1/c (14)
==============================================================================

- Date page updated: 2018-4-17
- Space group type: P2_1/c (14) / -P 2ybc
- Number of formula units (Z): 4
- Phonon raw data: :download:`mp-18183-20180417.tar.lzma <./mp-18183-20180417.tar.lzma>`
- Link to Materials Project: `https://www.materialsproject.org/materials/mp-18183/ <https://www.materialsproject.org/materials/mp-18183/>`_

Phonon band structure
----------------------

.. image:: mp-18183-band.png

Phonon DOS
-----------

.. image:: mp-18183-dos.png

Thermal properties at constant volume
--------------------------------------

Imaginary modes are excluded if they exist.

.. image:: mp-18183-tprops.png

POSCAR.yaml
----------------

POSCAR.yaml shows the crystal structure after the relaxation used for this phonon calculation.

::

   lattice:
   - [     8.8639126000000008,     0.0000000000000000,    -0.0087171200000000 ] # a
   - [     0.0000000000000000,     5.5781641300000002,     0.0000000000000000 ] # b
   - [    -5.5222971100000002,     0.0000000000000000,    10.5955472000000004 ] # c
   points:
   - symbol: F  # 1
     coordinates: [  0.2919636700000000,  0.5458438799999999,  0.9173996900000000 ]
     mass: 18.998403
   - symbol: F  # 2
     coordinates: [  0.7080363300000000,  0.0458438800000000,  0.5826003100000000 ]
     mass: 18.998403
   - symbol: F  # 3
     coordinates: [  0.7080363300000000,  0.4541561200000000,  0.0826003100000000 ]
     mass: 18.998403
   - symbol: F  # 4
     coordinates: [  0.2919636700000000,  0.9541561200000001,  0.4173996900000000 ]
     mass: 18.998403
   - symbol: F  # 5
     coordinates: [  0.7202579200000000,  0.5552169400000000,  0.5454293700000000 ]
     mass: 18.998403
   - symbol: F  # 6
     coordinates: [  0.2797420800000000,  0.0552169400000000,  0.9545706300000000 ]
     mass: 18.998403
   - symbol: F  # 7
     coordinates: [  0.2797420800000000,  0.4447830600000000,  0.4545706300000000 ]
     mass: 18.998403
   - symbol: F  # 8
     coordinates: [  0.7202579200000000,  0.9447830600000000,  0.0454293700000000 ]
     mass: 18.998403
   - symbol: F  # 9
     coordinates: [  0.4777170700000000,  0.2275997600000000,  0.8591921500000000 ]
     mass: 18.998403
   - symbol: F  # 10
     coordinates: [  0.5222829300000000,  0.7275997600000000,  0.6408078500000000 ]
     mass: 18.998403
   - symbol: F  # 11
     coordinates: [  0.5222829300000000,  0.7724002400000000,  0.1408078500000000 ]
     mass: 18.998403
   - symbol: F  # 12
     coordinates: [  0.4777170700000000,  0.2724002400000000,  0.3591921500000000 ]
     mass: 18.998403
   - symbol: F  # 13
     coordinates: [  0.9790567000000000,  0.2415931900000000,  0.0544199700000000 ]
     mass: 18.998403
   - symbol: F  # 14
     coordinates: [  0.0209433000000000,  0.7415931900000000,  0.4455800300000000 ]
     mass: 18.998403
   - symbol: F  # 15
     coordinates: [  0.0209433000000000,  0.7584068100000000,  0.9455800300000000 ]
     mass: 18.998403
   - symbol: F  # 16
     coordinates: [  0.9790567000000000,  0.2584068100000000,  0.5544199700000000 ]
     mass: 18.998403
   - symbol: F  # 17
     coordinates: [  0.2713294600000000,  0.0242004600000000,  0.6443962700000000 ]
     mass: 18.998403
   - symbol: F  # 18
     coordinates: [  0.7286705400000000,  0.5242004600000000,  0.8556037300000000 ]
     mass: 18.998403
   - symbol: F  # 19
     coordinates: [  0.7286705400000000,  0.9757995400000000,  0.3556037300000000 ]
     mass: 18.998403
   - symbol: F  # 20
     coordinates: [  0.2713294600000000,  0.4757995400000000,  0.1443962700000000 ]
     mass: 18.998403
   - symbol: F  # 21
     coordinates: [  0.2551469100000000,  0.9573951400000000,  0.1744825400000000 ]
     mass: 18.998403
   - symbol: F  # 22
     coordinates: [  0.7448530900000000,  0.4573951400000000,  0.3255174600000000 ]
     mass: 18.998403
   - symbol: F  # 23
     coordinates: [  0.7448530900000000,  0.0426048600000000,  0.8255174600000000 ]
     mass: 18.998403
   - symbol: F  # 24
     coordinates: [  0.2551469100000000,  0.5426048600000000,  0.6744825400000000 ]
     mass: 18.998403
   - symbol: F  # 25
     coordinates: [  0.0306018400000000,  0.5800975000000000,  0.2344047700000000 ]
     mass: 18.998403
   - symbol: F  # 26
     coordinates: [  0.9693981600000000,  0.0800975000000000,  0.2655952300000000 ]
     mass: 18.998403
   - symbol: F  # 27
     coordinates: [  0.9693981600000000,  0.4199025000000000,  0.7655952300000000 ]
     mass: 18.998403
   - symbol: F  # 28
     coordinates: [  0.0306018400000000,  0.9199025000000000,  0.7344047700000000 ]
     mass: 18.998403
   - symbol: Y  # 29
     coordinates: [  0.1861714800000000,  0.2421141200000000,  0.7656291300000000 ]
     mass: 88.905850
   - symbol: Y  # 30
     coordinates: [  0.8138285200000001,  0.7421141200000000,  0.7343708700000000 ]
     mass: 88.905850
   - symbol: Y  # 31
     coordinates: [  0.8138285200000001,  0.7578858800000000,  0.2343708700000000 ]
     mass: 88.905850
   - symbol: Y  # 32
     coordinates: [  0.1861714800000000,  0.2578858800000000,  0.2656291300000000 ]
     mass: 88.905850
   - symbol: Sn # 33
     coordinates: [  0.7281306700000000,  0.2433921500000000,  0.9569838600000000 ]
     mass: 118.710000
   - symbol: Sn # 34
     coordinates: [  0.2718693300000000,  0.7433921500000000,  0.5430161400000000 ]
     mass: 118.710000
   - symbol: Sn # 35
     coordinates: [  0.2718693300000000,  0.7566078500000000,  0.0430161400000000 ]
     mass: 118.710000
   - symbol: Sn # 36
     coordinates: [  0.7281306700000000,  0.2566078500000000,  0.4569838600000000 ]
     mass: 118.710000
   poscar_order:
   - 1
   - 2
   - 3
   - 4
   - 5
   - 6
   - 7
   - 8
   - 9
   - 10
   - 11
   - 12
   - 13
   - 14
   - 15
   - 16
   - 17
   - 18
   - 19
   - 20
   - 21
   - 22
   - 23
   - 24
   - 25
   - 26
   - 27
   - 28
   - 29
   - 30
   - 31
   - 32
   - 33
   - 34
   - 35
   - 36

Citation
-----------

.. _the Materials Project: https://www.materialsproject.org/
.. _the Materials Project citation: https://materialsproject.org/citing
.. _SeeK-path: http://materialscloud.org/tools/seekpath

..

The initial crystal structure used to perform phonon calculation is
obtained from `the Materials Project`_. The phonon band structure
paths are determined using `SeeK-path`_. More details about how to
obtain the crystal structure, how to determine the band structure
paths, and those citations are found at
:ref:`crystal_structure_and_citation`.

License
--------------

The contents of this web page are licensed under a `Creative Commons
4.0 Attribution International License
<http://creativecommons.org/licenses/by/4.0/>`_.

.. image :: https://i.creativecommons.org/l/by/4.0/88x31.png
   :target: http://creativecommons.org/licenses/by/4.0/
   :alt: license