[Wien] Compilation error with libxc

Dr. K. C. Bhamu kcbhamu85 at gmail.com
Wed Dec 28 11:27:32 CET 2016 

Thank you Prof, Peter

I put FC=ifort when libxc was installed.

The below reply may hel me but, its mixed so could not get it. Please help
to keep it in parts (the blue one),

try with this: i compiled wien2k_16.1 and it worked parfactly.
install_libxc3.00sudoapt-get install *autoconfsudoapt-get install
libtoolautoreconf-i.*/configureFC=ifort CC=iccmake,make check, (make checl |tee
results)sudomake installPath :/opt/etsf/lib/

Sincerely

Bhamu





On Tue, Dec 27, 2016 at 3:15 PM, Peter Blaha <pblaha at theochem.tuwien.ac.at>
wrote:

>
>
> On 12/24/2016 03:24 PM, Dr. K. C. Bhamu wrote:
>
>> Dear Users,
>> I compiled Wien2k_16.1 without any error on latest 64 bit Ubuntu OS on
>> Lenovo laptop with ifort+cc (2015).
>>
>> If I install with LIBXC, I am getting below error(compile.msg file is
>> attached here):
>>
>> Compile time errors (if any) were:
>> SRC_lapw0/compile.msg:inputpars.F(6): error #7013: This module file was
>> not generated by any release of this compiler.   [XC_F03_LIB_M]
>>
>
>
> When you install the libxc you probably have to tell him, that your
> fortran compiler is ifort (and not gfortran).
>
>
>
>
>
> SRC_lapw0/compile.msg:inputpars.F(17): error #6457: This derived type
>> name has not been declared.   [XC_F03_FUNC_T]
>> SRC_lapw0/compile.msg:inputpars.F(18): error #6457: This derived type
>> name has not been declared.   [XC_F03_FUNC_INFO_T]
>> SRC_lapw0/compile.msg:inputpars.F(161): error #6404: This name does not
>> have a type, and must have an explicit type.   [XC_FUNC]
>> SRC_lapw0/compile.msg:inputpars.F(161): error #6404: This name does not
>> have a type, and must have an explicit type.   [XC_UNPOLARIZED]
>> SRC_lapw0/compile.msg:inputpars.F(162): error #6404: This name does not
>> have a type, and must have an explicit type.   [XC_INFO]
>> SRC_lapw0/compile.msg:inputpars.F(162): error #6404: This name does not
>> have a type, and must have an explicit type.   [XC_F03_FUNC_GET_INFO]
>> SRC_lapw0/compile.msg:inputpars.F(163): error #6404: This name does not
>> have a type, and must have an explicit type.
>>  [XC_F03_FUNC_INFO_GET_FAMILY]
>> SRC_lapw0/compile.msg:inputpars.F(163): error #6608: In a CASE
>> statement, the case-expr must be of type INTEGER, CHARACTER, or LOGICAL.
>>   [XC_F03_FUNC_INFO_GET_FAMILY]
>> SRC_lapw0/compile.msg:inputpars.F(164): error #6404: This name does not
>> have a type, and must have an explicit type.   [XC_FAMILY_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(164): error #6601: In a CASE
>> statement, the case-value must be a constant expression.
>>  [XC_FAMILY_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(164): error #6612: In a CASE
>> statement, the case-value must be of type INTEGER, CHARACTER, or
>> LOGICAL.   [XC_FAMILY_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(164): error #6404: This name does not
>> have a type, and must have an explicit type.   [XC_FAMILY_HYB_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(164): error #6601: In a CASE
>> statement, the case-value must be a constant expression.
>> [XC_FAMILY_HYB_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(164): error #6612: In a CASE
>> statement, the case-value must be of type INTEGER, CHARACTER, or
>> LOGICAL.   [XC_FAMILY_HYB_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(173): error #6608: In a CASE
>> statement, the case-expr must be of type INTEGER, CHARACTER, or LOGICAL.
>>   [XC_F03_FUNC_INFO_GET_FAMILY]
>> SRC_lapw0/compile.msg:inputpars.F(174): error #6601: In a CASE
>> statement, the case-value must be a constant expression.
>>  [XC_FAMILY_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(174): error #6612: In a CASE
>> statement, the case-value must be of type INTEGER, CHARACTER, or
>> LOGICAL.   [XC_FAMILY_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(174): error #6601: In a CASE
>> statement, the case-value must be a constant expression.
>> [XC_FAMILY_HYB_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(174): error #6612: In a CASE
>> statement, the case-value must be of type INTEGER, CHARACTER, or
>> LOGICAL.   [XC_FAMILY_HYB_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(189): error #6608: In a CASE
>> statement, the case-expr must be of type INTEGER, CHARACTER, or LOGICAL.
>>   [XC_F03_FUNC_INFO_GET_FAMILY]
>> SRC_lapw0/compile.msg:inputpars.F(190): error #6601: In a CASE
>> statement, the case-value must be a constant expression.
>>  [XC_FAMILY_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(190): error #6612: In a CASE
>> statement, the case-value must be of type INTEGER, CHARACTER, or
>> LOGICAL.   [XC_FAMILY_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(190): error #6601: In a CASE
>> statement, the case-value must be a constant expression.
>> [XC_FAMILY_HYB_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(190): error #6612: In a CASE
>> statement, the case-value must be of type INTEGER, CHARACTER, or
>> LOGICAL.   [XC_FAMILY_HYB_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(195): error #6608: In a CASE
>> statement, the case-expr must be of type INTEGER, CHARACTER, or LOGICAL.
>>   [XC_F03_FUNC_INFO_GET_FAMILY]
>> SRC_lapw0/compile.msg:inputpars.F(196): error #6601: In a CASE
>> statement, the case-value must be a constant expression.
>>  [XC_FAMILY_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(196): error #6612: In a CASE
>> statement, the case-value must be of type INTEGER, CHARACTER, or
>> LOGICAL.   [XC_FAMILY_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(196): error #6601: In a CASE
>> statement, the case-value must be a constant expression.
>> [XC_FAMILY_HYB_MGGA]
>> SRC_lapw0/compile.msg:inputpars.F(196): error #6612: In a CASE
>> statement, the case-value must be of type INTEGER, CHARACTER, or
>> LOGICAL.   [XC_FAMILY_HYB_MGGA]
>> SRC_lapw0/compile.msg:/tmp/ifort150RO5.i(813): catastrophic error: Too
>> many errors, exiting
>> SRC_lapw0/compile.msg:make[1]: *** [inputpars.o] Error 1
>> SRC_lapw0/compile.msg:make: *** [seq] Error 2
>>
>>
>> Check file   compile.msg   in the corresponding SRC_* directory for the
>> compilation log and more info on any compilation problem.
>>
>>      Press RETURN to continue
>>
>> Please suggest me how to get rig of this problem.
>>
>> PFA comile.msg
>>
>>
>> Sincerely
>> Bhamu
>>
>>
>> _______________________________________________
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>>
>>
> --
>
>                                       P.Blaha
> --------------------------------------------------------------------------
> Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
> Phone: +43-1-58801-165300             FAX: +43-1-58801-165982
> Email: blaha at theochem.tuwien.ac.at    WIEN2k: http://www.wien2k.at
> WWW:   http://www.imc.tuwien.ac.at/TC_Blaha
> --------------------------------------------------------------------------
> _______________________________________________
> Wien mailing list
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