[Pw_forum] crystal structure and atomic coordinates of individual elements?

[Mike Mehl]

@Book{donohue74:elements,
author =         {Jerry Donohue},
title =          {The Structures of the Elements},
publisher =      {John Wiley \& Sons},
year =   1974,
address =        {New York}}

He's a little out of date for some elements, e.g. Boron.

The American Mineralogist Crystal Structure Database is also helpful. 
There is even a structure for gamma-oxygen.

http://rruff.geo.arizona.edu/AMS/amcsd.php


On 08/12/2010 08:43 AM, sonu kumar wrote:
> Dear all QE users,
>
> Can anybody provide me any help or link  etc, where i can find the
> crystal structure and wyckoff positions of individual elements like Ti,
> O, Rh etc.
>
> I shall be very thankful to you .

-- 
Michael J. Mehl
Head, Center for Computational Materials Science
Naval Research Laboratory Code 6390
Washington DC