[Wien] Compile time error in WIEN2k_24.1 using oneAPI

Gavin Abo gabo13279 at gmail.com
Wed Apr 30 09:14:41 CEST 2025


In step 9 of [1], you might have missed applying the patches at [2] such 
as charge.patch for charge.f and SearchZ.patch for SearchZ.F.

[1] 
https://github.com/gsabo/WIEN2k-Docs/blob/main/WIEN2k24.1_Ubuntu22.04_Install_with_OneAPI(ifx).pdf
[2] https://github.com/gsabo/WIEN2k-Patches/tree/master/24.1

On 4/30/2025 12:52 AM, Peeyush Kumar Kamlesh wrote:
> Dear Sir
> I am trying to install WIEN2k_24.1 with the help of a file given by 
> Prof. Abo using Intel oneAPI.
> during installation, in place of ifort I used ifx
> in place of icc I used icx
> and in place of mpiifort I used mpiifx
>
> i found following compile time errors. Kindly help in solving these erros
> Compile time errors (if any) were:
> SRC_dstart/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_dstart/compile.msg:make[1]: *** [Makefile:137: charge.o] Error 3
> SRC_dstart/compile.msg:make: *** [Makefile:90: seq] Error 2
> SRC_dstart/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_dstart/compile.msg:make[1]: *** [Makefile:137: charge.o] Error 3
> SRC_dstart/compile.msg:make: *** [Makefile:93: para] Error 2
> SRC_hf/compile.msg:charge.f: error #5633: **Internal compiler error: 
> segmentation violation signal raised** Please report this error along 
> with the circumstances in which it occurred in a Software Problem 
> Report.  Note: File and line given may not be explicit cause of this 
> error.
> SRC_hf/compile.msg:make[1]: *** [Makefile:275: charge.o] Error 3
> SRC_hf/compile.msg:make: *** [Makefile:181: real] Error 2
> SRC_hf/compile.msg:charge.f: error #5633: **Internal compiler error: 
> segmentation violation signal raised** Please report this error along 
> with the circumstances in which it occurred in a Software Problem 
> Report.  Note: File and line given may not be explicit cause of this 
> error.
> SRC_hf/compile.msg:make[1]: *** [Makefile:275: charge.o] Error 3
> SRC_hf/compile.msg:make: *** [Makefile:185: complex] Error 2
> SRC_hf/compile.msg:charge.f: error #5633: **Internal compiler error: 
> segmentation violation signal raised** Please report this error along 
> with the circumstances in which it occurred in a Software Problem 
> Report.  Note: File and line given may not be explicit cause of this 
> error.
> SRC_hf/compile.msg:make[1]: *** [Makefile:275: charge.o] Error 3
> SRC_hf/compile.msg:make: *** [Makefile:189: rp] Error 2
> SRC_hf/compile.msg:charge.f: error #5633: **Internal compiler error: 
> segmentation violation signal raised** Please report this error along 
> with the circumstances in which it occurred in a Software Problem 
> Report.  Note: File and line given may not be explicit cause of this 
> error.
> SRC_hf/compile.msg:make[1]: *** [Makefile:275: charge.o] Error 3
> SRC_hf/compile.msg:make: *** [Makefile:193: cp] Error 2
> SRC_lapw0/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_lapw0/compile.msg:make[1]: *** [Makefile:174: charge.o] Error 3
> SRC_lapw0/compile.msg:make: *** [Makefile:125: seq] Error 2
> SRC_lapw0/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_lapw0/compile.msg:make[1]: *** [Makefile:174: charge.o] Error 3
> SRC_lapw0/compile.msg:make: *** [Makefile:129: para] Error 2
> SRC_lapw1/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_lapw1/compile.msg:make[1]: *** [Makefile:264: charge.o] Error 3
> SRC_lapw1/compile.msg:make: *** [Makefile:170: real] Error 2
> SRC_lapw1/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_lapw1/compile.msg:make[1]: *** [Makefile:264: charge.o] Error 3
> SRC_lapw1/compile.msg:make: *** [Makefile:174: complex] Error 2
> SRC_lapw1/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_lapw1/compile.msg:make[1]: *** [Makefile:264: charge.o] Error 3
> SRC_lapw1/compile.msg:make: *** [Makefile:178: rp] Error 2
> SRC_lapw1/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_lapw1/compile.msg:make[1]: *** [Makefile:264: charge.o] Error 3
> SRC_lapw1/compile.msg:make: *** [Makefile:182: cp] Error 2
> SRC_lapw2/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_lapw2/compile.msg:make[1]: *** [Makefile:264: charge.o] Error 3
> SRC_lapw2/compile.msg:make: *** [Makefile:169: real] Error 2
> SRC_lapw2/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_lapw2/compile.msg:make[1]: *** [Makefile:264: charge.o] Error 3
> SRC_lapw2/compile.msg:make: *** [Makefile:173: complex] Error 2
> SRC_lapw2/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_lapw2/compile.msg:make[1]: *** [Makefile:264: charge.o] Error 3
> SRC_lapw2/compile.msg:make: *** [Makefile:177: rp] Error 2
> SRC_lapw2/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_lapw2/compile.msg:make[1]: *** [Makefile:264: charge.o] Error 3
> SRC_lapw2/compile.msg:make: *** [Makefile:181: cp] Error 2
> SRC_lapw5/compile.msg:SearchZ_tmp_.F(114): error #5623: **Internal 
> compiler error: internal abort** Please report this error along with 
> the circumstances in which it occurred in a Software Problem Report.  
> Note: File and line given may not be explicit cause of this error.
> SRC_lapw5/compile.msg:make[1]: *** [Makefile:122: SearchZ.o] Error 3
> SRC_lapw5/compile.msg:make: *** [Makefile:74: real] Error 2
> SRC_lapw5/compile.msg:SearchZ_tmp_.F(114): error #5623: **Internal 
> compiler error: internal abort** Please report this error along with 
> the circumstances in which it occurred in a Software Problem Report.  
> Note: File and line given may not be explicit cause of this error.
> SRC_lapw5/compile.msg:make[1]: *** [Makefile:122: SearchZ.o] Error 3
> SRC_lapw5/compile.msg:make: *** [Makefile:77: complex] Error 2
> SRC_lcore/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_lcore/compile.msg:make: *** [Makefile:102: charge.o] Error 3
> SRC_mixer/compile.msg:charge.f: error #5633: **Internal compiler 
> error: segmentation violation signal raised** Please report this error 
> along with the circumstances in which it occurred in a Software 
> Problem Report.  Note: File and line given may not be explicit cause 
> of this error.
> SRC_mixer/compile.msg:make: *** [Makefile:161: charge.o] Error 3
>
>
> Best Regards
> Peeyush Kamlesh
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