[Wien] lapw0 compilation give errors

Wien2k User wien2k.user at gmail.com
Sat Dec 14 12:38:40 CET 2019


Dear Prof. F. Tran

the error was due to an overwriting of an old installation of libxc by a
new one
to resolve this problem, we must delete the old version or install the new
one in another location

Le ven. 13 déc. 2019 à 17:21, Tran, Fabien <fabien.tran at tuwien.ac.at> a
écrit :

> Did you use the same compilers for libxc?
>
>
> ------------------------------
> *From:* Wien <wien-bounces at zeus.theochem.tuwien.ac.at> on behalf of Wahid
> Kamal <kamal.wahhid at gmail.com>
> *Sent:* Friday, December 13, 2019 3:52 PM
> *To:* Wien at zeus.theochem.tuwien.ac.at
> *Subject:* [Wien] lapw0 compilation give errors
>
> Dear wien2k users and developers
> I got these errors when compiling lapw0 despite installing libxc.4.3.4
> with ifort and icc
>
> inputpars.F(6): error #7013: This module file was not generated by any
> release of this compiler.   [XC_F03_LIB_M]
>       use xc_f03_lib_m
> ----------^
> inputpars.F(17): error #6457: This derived type name has not been
> declared.   [XC_F03_FUNC_T]
>       TYPE(xc_f03_func_t) :: xc_func
> -----------^
> inputpars.F(18): error #6457: This derived type name has not been
> declared.   [XC_F03_FUNC_INFO_T]
>       TYPE(xc_f03_func_info_t) :: xc_info
> -----------^
> inputpars.F(165): error #6404: This name does not have a type, and must
> have an explicit type.   [XC_FUNC]
>           call xc_f03_func_init(xc_func,id_func_x,XC_UNPOLARIZED)
> --------------------------------^
> inputpars.F(165): error #6404: This name does not have a type, and must
> have an explicit type.   [XC_UNPOLARIZED]
>           call xc_f03_func_init(xc_func,id_func_x,XC_UNPOLARIZED)
> --------------------------------------------------^
> inputpars.F(166): error #6404: This name does not have a type, and must
> have an explicit type.   [XC_INFO]
>           xc_info = xc_f03_func_get_info(xc_func)
> ----------^
> inputpars.F(166): error #6404: This name does not have a type, and must
> have an explicit type.   [XC_F03_FUNC_GET_INFO]
>           xc_info = xc_f03_func_get_info(xc_func)
> --------------------^
> inputpars.F(167): error #6404: This name does not have a type, and must
> have an explicit type.   [XC_F03_FUNC_INFO_GET_FAMILY]
>           select case(xc_f03_func_info_get_family(xc_info))
> ----------------------^
> inputpars.F(167): error #6608: In a CASE statement, the case-expr must be
> of type INTEGER, CHARACTER, or LOGICAL.   [XC_F03_FUNC_INFO_GET_FAMILY]
>           select case(xc_f03_func_info_get_family(xc_info))
> ----------------------^
> inputpars.F(168): error #6404: This name does not have a type, and must
> have an explicit type.   [XC_FAMILY_MGGA]
>           case (xc_family_mgga,xc_family_hyb_mgga)
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