Introduction to the Octopus code - TDDFT.org
Introduction to the Octopus code - TDDFT.org
Introduction to the Octopus code - TDDFT.org
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Boundary conditions<br />
Optimize <strong>the</strong> shape of <strong>the</strong> box <strong>to</strong> minimize <strong>the</strong> number of points.<br />
General box shape:<br />
Minimum box: a sphere around each a<strong>to</strong>m.<br />
Sphere.<br />
Cylinder.<br />
Parallelepiped.<br />
Arbitrary.<br />
X. Andrade (EHU/UPV) <strong>Introduction</strong> <strong>to</strong> Oc<strong>to</strong>pus Benasque, September 2008 8 / 20
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