mami - 19-8-2009 at 00:50
Hi,
please tell me a Book for application of computer in chemistry.
Thanks
entropy51 - 19-8-2009 at 07:46
http://files.rushim.ru/books/mathchemie/computational-chemis...
JohnWW - 19-8-2009 at 10:31
Encyclopedia Of Computational Chemistry (Wiley-1998):
http://www.freshlap.com/2009/08/06/encyclopedia-of-computati...
353 Mb, 3,580 pages in 5 volumes
JohnWW - 19-8-2009 at 16:27
Another book on the same subject:
Essentials Of Computational Chemistry Theories And Models - Cramer, C.J. (2002) 13.2 Mb
Found here: http://www.filestube.com/18c5db3ca1be066303e9/go.html
There are some more books on the subject in these fairly recent pages, but I have not yet checked whether the links are still valid; registration is
needed to view them:
http://www.addebook.com/tech/chemistry/computational-chemist...
http://www.addebook.com/tech/chemistry/theoretical-aspects-o...
http://www.addebook.com/tech/materials/molecular-and-nano-el...
http://www.addebook.com/tech/materials/nanomaterials-design-...
http://www.addebook.com/tech/chemistry/reviews-in-computatio...
http://www.addebook.com/tech/chemistry/reviews-in-computatio...
http://www.addebook.com/tech/chemistry/relativistic-electron...
http://www.addebook.com/tech/materials/energetic-materials-v...
http://www.addebook.com/tech/chemistry/molecular-materials-w...
http://www.addebook.com/tech/chemistry/computational-chemist...
http://www.addebook.com/tech/chemistry/radiation-induced-mol...
http://www.addebook.com/tech/chemistry/chemistry-and-chemica...
http://www.addebook.com/tech/chemistry/chemistry-and-chemica...
http://www.addebook.com/tech/chemistry/molecular-and-particl...
http://www.addebook.com/tech/chemistry/advances-in-molecular...
[Edited on 20-8-09 by JohnWW]
len1 - 19-8-2009 at 23:39
These answer the question only if what was meant is 'application of computers in theoretical chemistry'. This basically reduces to any aspect of
quantitative chemistry - as anything quantitative can be put on a computer - the Nernst equation, complex equilibria, kinetic ODE solutions, etc.
A different question, as I originally understood it, s the use of computers in experimental chemistry - it is after all by its nature an experimental
science. Of this I dont think there are many examples.
RiP057 - 27-10-2010 at 10:46
cramers book is the best he is a phenomenal computational chemist....
HighTek - 7-10-2012 at 02:17
All links are dead with the exception of the first link posted by entropy51