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DFT: Equilibrium structure and binding energy of a diatomic molecule Cl2 (Tutorial 2.1)
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James Overhiser
February 14, 2019
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2018 PARADIM SUMMER SCHOOL Lab 2
Tags
state functions
bond lengths
point
calculation
communication
smallest energy
philosophical terminology
concepts in physics
number
approximation
input file
chemical elements
self-consistent
final energy
mathematical terminology
reference frame
top-level domains
caption complete
atomic physics
quantum mechanics
experiment
scientific terminology
systems
input/output
parameter
energy
+ 19 more
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PARADIM
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