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Author Topic: Lattice parameter of VTe2  (Read 3274 times)

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Offline abhishek77492652

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Lattice parameter of VTe2
« on: December 16, 2017, 17:44 »
Hello sir ,
can you please provide me the lattice parameter of VTe2  ?
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Offline Petr Khomyakov

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Re: Lattice parameter of VTe2
« Reply #1 on: December 16, 2017, 21:32 »
What do you mean by "provide me the lattice constant"? If you want to know the measured value, you should google it, or search the literature. Otherwise, you have to do geometry optimization for this system, using some appropriate method.
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Offline Ulrik G. Vej-Hansen

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Re: Lattice parameter of VTe2
« Reply #2 on: December 16, 2017, 21:33 »
No, you should always calculate the equilibrium lattice constant using your chosen computational model. The reference value from our database, or wherever you have the structure from, is usually a good place to start from.
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