[xcrysden] 回复: XCrySDen Digest, Vol 138, Issue 3

[Chen, Feiran]

Hi Professor Boulet,

Thank you! I have solved problem. I just changed the script. All the thing goes well.

Best wishes
Feiran Chen
________________________________
发件人: xcrysden-bounces at democritos.it <xcrysden-bounces at democritos.it> 代表 pboulet <pascal.boulet at univ-amu.fr>
发送时间: 2021年1月26日 5:51
收件人: xcrysden at democritos.it <xcrysden at democritos.it>
主题: Re: [xcrysden] XCrySDen Digest, Vol 138, Issue 3

Hello,

bc is the basic calculator provided by linux. It could be that it is not installed in your cygwin bundle. Check this and install it if it is not.

HTH,

Pascal Boulet
―
Professor in computational materials chemistry - DEPARTMENT OF CHEMISTRY
University of Aix-Marseille - Avenue Escadrille Normandie Niemen - F-13013 Marseille - FRANCE
Tél: +33(0)4 13 55 18 10 - Fax : +33(0)4 13 55 18 50
Email : pascal.boulet at univ-amu.fr<mailto:pascal.boulet at univ-amu.fr>









Le 26 janv. 2021 à 07:35, <xcrysden-request at democritos.it<mailto:xcrysden-request at democritos.it>> <xcrysden-request at democritos.it<mailto:xcrysden-request at democritos.it>> a écrit :

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Today's Topics:

  1. XcrySDen error (Chen, Feiran)


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Message: 1
Date: Tue, 26 Jan 2021 05:01:48 +0000
From: "Chen, Feiran" <Feiran_Chen at student.uml.edu>
Subject: [xcrysden] XcrySDen error
To: "xcrysden at democritos.it" <xcrysden at democritos.it>
Message-ID:
<SN6PR02MB56625FF41B2470CBAED6B15EDBBC9 at SN6PR02MB5662.namprd02.prod.outlook.com>

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Hi,

I have already installed the XcrySDen Windows cygwin64 followed by instruction. And I can open XcrySDen successfully. I also can open a input file well. But when I tried to open a output file, the error came out. The error list below:
/xcrysden-1.6.2-bin-shared/scripts/pwo2xsf.sh: line 95: bc: command not found

And In the file of pwo2xsf.sh. I found the error line is shown below:
result=`echo "$version < 1.3"|bc -l`

So can you help me solve this problem? Thank you!

Best wishes
Elvin Chen
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