<html><head><meta http-equiv="Content-Type" content="text/html charset=us-ascii"></head><body style="word-wrap: break-word; -webkit-nbsp-mode: space; -webkit-line-break: after-white-space;" class=""><div dir="auto" style="word-wrap: break-word; -webkit-nbsp-mode: space; -webkit-line-break: after-white-space;" class=""><div dir="auto" style="word-wrap: break-word; -webkit-nbsp-mode: space; -webkit-line-break: after-white-space;" class=""><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">Hi Paolo,</span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class=""><br class=""></span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class="">Thank you for your suggestion.</div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class="">Setting FFTW_INCLUDE to the location of fftw3.f03, shows following messages:</div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><br class=""></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""> </div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">mpif90 -O3 -g -fopenmp -cpp -fopenmp -D__FFTW3 -D__MPI -D__SCALAPACK -I/home/chandan_prescience_in/apps/blis/include -I/home/chandan_prescience_in/apps/libFLAME/include -I/home/chandan_prescience_in/apps/amd-fftw/double/include -I/home/chandan_prescience_in/apps/q-e-qe-6.7.0/include -I/home/chandan_prescience_in/apps/q-e-qe-6.7.0/FoX/finclude -c fft_scalar.ESSL.f90</span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class=""><font color="#ff2600" class="">F90-W-0006-Input file empty (fft_scalar.ESSL.f90)</font></span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">F90/x86-64 Linux Flang - 1.5 2017-05-01: compilation completed with warnings</span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">mpif90 -O3 -g -fopenmp -cpp -fopenmp -D__FFTW3 -D__MPI -D__SCALAPACK -I/home/chandan_prescience_in/apps/blis/include -I/home/chandan_prescience_in/apps/libFLAME/include -I/home/chandan_prescience_in/apps/amd-fftw/double/include -I/home/chandan_prescience_in/apps/q-e-qe-6.7.0/include -I/home/chandan_prescience_in/apps/q-e-qe-6.7.0/FoX/finclude -c fft_scalar.FFTW.f90</span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class=""><font color="#ff2600" class="">F90-W-0006-Input file empty (fft_scalar.FFTW.f90)</font></span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">F90/x86-64 Linux Flang - 1.5 2017-05-01: compilation completed with warnings</span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">mpif90 -O3 -g -fopenmp -cpp -fopenmp -D__FFTW3 -D__MPI -D__SCALAPACK -I/home/chandan_prescience_in/apps/blis/include -I/home/chandan_prescience_in/apps/libFLAME/include -I/home/chandan_prescience_in/apps/amd-fftw/double/include -I/home/chandan_prescience_in/apps/q-e-qe-6.7.0/include -I/home/chandan_prescience_in/apps/q-e-qe-6.7.0/FoX/finclude -c fft_scalar.FFTW3.f90</span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">mpif90 -O3 -g -fopenmp -cpp -fopenmp -D__FFTW3 -D__MPI -D__SCALAPACK -I/home/chandan_prescience_in/apps/blis/include -I/home/chandan_prescience_in/apps/libFLAME/include -I/home/chandan_prescience_in/apps/amd-fftw/double/include -I/home/chandan_prescience_in/apps/q-e-qe-6.7.0/include -I/home/chandan_prescience_in/apps/q-e-qe-6.7.0/FoX/finclude -c fft_scalar.SX6.f90</span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">F90-W-0006-Input file empty (fft_scalar.SX6.f90)</span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class=""><font color="#ff2600" class="">F90/x86-64 Linux Flang - 1.5 2017-05-01: compilation completed with warnings</font></span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class="">...</div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">...</span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class=""><div style="margin: 0px; line-height: normal;" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">mpif90 -O3 -g -fopenmp -cpp -fopenmp -D__FFTW3 -D__MPI -D__SCALAPACK -I/home/chandan_prescience_in/apps/blis/include -I/home/chandan_prescience_in/apps/libFLAME/include -I/home/chandan_prescience_in/apps/amd-fftw/double/include -I/home/chandan_prescience_in/apps/q-e-qe-6.7.0/include -I/home/chandan_prescience_in/apps/q-e-qe-6.7.0/FoX/finclude -I/home/chandan_prescience_in/softwares/q-e-qe-6.7.0//upflib -I/home/chandan_prescience_in/softwares/q-e-qe-6.7.0//Modules -I/home/chandan_prescience_in/softwares/q-e-qe-6.7.0//FFTXlib -I/home/chandan_prescience_in/softwares/q-e-qe-6.7.0//LAXlib -I/home/chandan_prescience_in/softwares/q-e-qe-6.7.0//UtilXlib -I/home/chandan_prescience_in/softwares/q-e-qe-6.7.0//FoX/finclude -I../ELPA/src -c fox_init_module.f90</span></div><div style="margin: 0px; line-height: normal;" class=""><span style="font-variant-ligatures: no-common-ligatures" class=""><font color="#ff2600" class="">F90-F-0004-Corrupt or Old Module file </font>/home/chandan_prescience_in/apps/q-e-qe-6.7.0/FoX/finclude/m_common_io.mod (fox_init_module.f90: 4)</span></div><div style="margin: 0px; line-height: normal;" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">F90/x86-64 Linux Flang - 1.5 2017-05-01: compilation aborted</span></div><div style="margin: 0px; line-height: normal;" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">make[1]: *** [../make.inc:16: fox_init_module.o] Error 1</span></div><div style="margin: 0px; line-height: normal;" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">make[1]: Leaving directory '/home/chandan_prescience_in/softwares/q-e-qe-6.7.0/Modules'</span></div><div style="margin: 0px; line-height: normal;" class=""><span style="font-variant-ligatures: no-common-ligatures" class="">make: *** [Makefile:179: mods] Error 1</span></div></span></div><div style="margin: 0px; font-size: 16px; line-height: normal; font-family: 'Noto Mono'; background-color: rgb(255, 255, 255);" class=""><span style="font-variant-ligatures: no-common-ligatures" class=""><br class=""></span></div><div class="">Any suggestions to overcome this one?</div><div class=""><br class=""></div><div class="">Thank you!</div><div class="">
<div style="color: rgb(0, 0, 0); font-family: 'Noto Sans'; font-size: 15px; font-style: normal; font-variant-caps: normal; font-weight: normal; letter-spacing: normal; orphans: auto; text-align: start; text-indent: 0px; text-transform: none; white-space: normal; widows: auto; word-spacing: 0px; -webkit-text-size-adjust: auto; -webkit-text-stroke-width: 0px;">--<br class="">Chandan Kumar Choudhury, PhD<br class="">Post Doctoral Fellow<br class="">Prof. O. Kuksenok<br class="">Sirrine Hall<br class="">Materials Science and Engineering <br class="">Clemson University<br class="">Clemson, SC 29634</div>
</div>
<br class=""><div><blockquote type="cite" class=""><div class="">On Mar 11, 2021, at 2:17 PM, Paolo Giannozzi <<a href="mailto:p.giannozzi@gmail.com" class="">p.giannozzi@gmail.com</a>> wrote:</div><br class="Apple-interchange-newline"><div class=""><div dir="ltr" class=""><div dir="ltr" class="">On Thu, Mar 11, 2021 at 8:54 AM Chandan Kumar Choudhury <<a href="mailto:ckchoud@g.clemson.edu" class="">ckchoud@g.clemson.edu</a>> wrote:<br class=""></div><div class="gmail_quote"><div class=""> </div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div style="overflow-wrap: break-word;" class=""><div style="font-family:NotoSans-Regular" class=""><div style="margin:0px;font-size:16px;line-height:normal;font-family:"Noto Mono";background-color:rgb(255,255,255)" class=""><span style="font-variant-ligatures:no-common-ligatures" class="">F90-F-0906-Can't find include file fftw3.f03 (fft_scalar.FFTW3.f90: 40)</span></div><div style="margin:0px;font-size:16px;line-height:normal;font-family:"Noto Mono";background-color:rgb(255,255,255)" class=""><span style="font-variant-ligatures:no-common-ligatures" class="">F90/x86-64 Linux Flang - 1.5 2017-05-01: compilation aborted</span></div></div></div></blockquote><div class=""><br class=""></div><div class="">locate file fftw3.f03 in your software, set FFTW_INCLUDE accordingly, or copy the file into the include/ directory<br class=""></div></div><br class="">-- <br class=""><div dir="ltr" class="gmail_signature"><div dir="ltr" class=""><div class=""><div dir="ltr" class=""><div class="">Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,<br class="">Univ. Udine, via delle Scienze 206, 33100 Udine, Italy<br class="">Phone +39-0432-558216, fax +39-0432-558222<br class=""><br class=""></div></div></div></div></div></div>
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