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贺仪

铁杆木虫 (著名写手)

[交流] 【求助】climb neb install 已有2人参与

vasp.5.2.11
i have done all thing she(http://theory.cm.utexas.edu/vtsttools/downloads/) said, but also get wrong. here is the wrong message :


mpif90 -FR -lowercase -assume byterecl -heap-arrays  64 -O2 -ip -ftz   -c hessian.f90
hessian.f90(22): error #6457: This derived type name has not been declared.   [IN_STRUCT]
         TYPE (in_struct) :: IO
---------------^
hessian.f90(49): error #6404: This name does not have a type, and must have an explicit type.   [IO]
         IF (IO%IU0>=0) write(*,*) 'HMAT has been reset!'
-------------^
hessian.f90(49): error #6460: This is not a field name that is defined in the encompassing structure.   [IU0]
         IF (IO%IU0>=0) write(*,*) 'HMAT has been reset!'
----------------^
compilation aborted for hessian.f90 (code 1)


what should i  do ?

[ Last edited by 贺仪 on 2011-3-10 at 14:51 ]
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wuli8

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小木虫(金币+0.5):给个红包,谢谢回帖交流
youzhizhe(金币+1): 谢谢交流。 2011-03-28 08:07:25
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2楼2011-03-27 23:31:50
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贺仪

铁杆木虫 (著名写手)

引用回帖:
Originally posted by wuli8 at 2011-03-27 23:31:50:
建议到http://cms.mpi.univie.ac.at/vasp-forum/forum.php搜索一下下

谢谢 已经弄好了我写的 当然也是网上搜到的
http://hi.baidu.com/heyi87/blog/ ... 7ab5efb2fb95d2.html
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3楼2011-03-28 10:23:14
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