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Å­³åÐǺÓ: ½ð±Ò+45, ¡ï¡ï¡ï¡ï¡ï×î¼Ñ´ð°¸ 2013-10-16 18:47:24
franch: ½ð±Ò+2, лл»ØÌû½»Á÷ 2013-10-21 21:41:04
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2Â¥2013-10-15 23:13:26
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ustbwgs

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Å­³åÐǺÓ: ½ð±Ò+1, ¡ïÓаïÖú 2013-10-16 18:47:35
franch: ½ð±Ò+2, лл»ØÌû½»Á÷ 2013-10-21 21:41:13
I suggest you finding a fortran program (which was tested to be right by many works) to fit it. There are a lot. Maybe you could find from you supervisor or classmate. I am sure they have, if they did first principle calculation before. Don't fit it using origin. The accuracy is not as high as you expect.
doingwhatishoulddo!
5Â¥2013-10-16 00:58:24
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Germanman

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Å­³åÐǺÓ: ½ð±Ò+1, ¡ïÓаïÖú 2013-10-16 18:47:42
franch: ½ð±Ò+2, лл»ØÌû½»Á÷ 2013-10-21 21:41:20
use murn.tar.gz after untar it on a linux OS.
To download it, see here http://th.fhi-berlin.mpg.de/th/fhi98md/download/index.html#fhipp
6Â¥2013-10-16 08:03:05
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6Â¥: Originally posted by Germanman at 2013-10-16 08:03:05
use murn.tar.gz after untar it on a linux OS.
To download it, see here http://th.fhi-berlin.mpg.de/th/fhi98md/download/index.html#fhipp

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5Â¥: Originally posted by ustbwgs at 2013-10-16 00:58:24
I suggest you finding a fortran program (which was tested to be right by many works) to fit it. There are a lot. Maybe you could find from you supervisor or classmate. I am sure they have, if they di ...

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3Â¥: Originally posted by ÖÁ×ðɽÑò at 2013-10-15 23:30:16
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franch: ½ð±Ò+2, лл»ØÌû½»Á÷ 2013-10-21 21:41:29
ÒýÓûØÌû:
9Â¥: Originally posted by Å­³åÐÇºÓ at 2013-10-16 13:22:05
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