<div dir="ltr">Thank Ole.<div>Yes, I tried exactly what's is written on the howto pages, it didn't work. The only way I managed it to compile is using -D__ELPA3 On Friday, June 16, 2017 at 7:21:56 AM UTC-7, Ole Schütt wrote:<blockquote class="gmail_quote" style="margin: 0;margin-left: 0.8ex;border-left: 1px #ccc solid;padding-left: 1ex;">Sorry, I forgot to mention that you also need to add the following two include directories to FCFLAGS: -I$(ELPA_INCLUDE_DIR)/modules -I$(ELPA_INCLUDE_DIR)/elpa The compiler has to be able to find "elpa_kernel_constants.h" and "elpa2.mod" . -Ole On 2017-06-16 16:11, Luiz Fernando Lopes Oliveira wrote: > Hi Ole. Thanks for your reply. > Well, as I mentioned in my first message using the flags as said in > the HOWTOs pages I couldn't even compile the code. > The error I got using -D__ELPA=201605 is the following: > _CP2K/SRC/FM/CP_FM_ELPA.F:23: ERROR: ELPA_KERNEL_CONSTANTS.H: NO SUCH > FILE OR DIRECTORY_ > > On Friday, June 16, 2017 at 4:45:33 AM UTC-7, Ole Schütt wrote: > >> Hi Luiz, >> >> the flags for ELPA have recently been changed: >> >> > <a href="https://www.cp2k.org/howto:compile#l_elpa_optional_improved_performance_for_diagonalization" target="_blank" rel="nofollow" onmousedown="this.href='https://www.google.com/url?q\x3dhttps%3A%2F%2Fwww.cp2k.org%2Fhowto%3Acompile%23l_elpa_optional_improved_performance_for_diagonalization\x26sa\x3dD\x26sntz\x3d1\x26usg\x3dAFQjCNFJFILzobt9hWkKcn0p3Apwa4Povg';return true;" onclick="this.href='https://www.google.com/url?q\x3dhttps%3A%2F%2Fwww.cp2k.org%2Fhowto%3Acompile%23l_elpa_optional_improved_performance_for_diagonalization\x26sa\x3dD\x26sntz\x3d1\x26usg\x3dAFQjCNFJFILzobt9hWkKcn0p3Apwa4Povg';return true;">https://www.cp2k.org/howto:compile#l_elpa_optional_improved_performance_for_diagonalization</a> >> [1] >> >> You will need to use -D__ELPA=201605 . >> >> -Ole >> >> On 2017-06-16 02:43, Luiz Fernando Lopes Oliveira wrote: >>> Hi. >>> >>> I sucessufuly compiled elpa-2016.05 and added these flats to my >> .arch >>> file: >>> >>> ELPA_INC=/path/elpa-2016.05.004/build/include >>> ELPA_LIB=/path/elpa-2016.05.004/build/lib >>> DFLAGS += -D__ELPA3 >>> FCFLAGS += -I$(ELPA_INC) >>> LDFLAGS +=-L$(ELPAROOT) >>> LIBS += -L$(ELPA_LIB) -lelpa >>> CPPFLAGS += -I$(ELPA_INC) >>> >>> which produced no error during the CP2K compilation. >>> >>> I had to use LD_LIBRARY_PATH and point to libelpa.so.4. >>> >>> So far so good, my problem comes when I used the keyword >>> PREFERRED_DIAG_LIBRARY ELPA in my input, the output says WARNING : >> >>> DIAGONALIZATION library ELPA is not available Trying SCALAPACK >>> >>> Am I using the correct the correct flags in .arch file? >>> >>> I know that that's not what the HOWTO page says, but using those >> flags >>> I couldn't even compile the code. >>> I found the ones I mentioned above here in the forum. >>> >>> -- >>> You received this message because you are subscribed to the Google >> >>> Groups "cp2k" group. >>> To unsubscribe from this group and stop receiving emails from it, >> send >>> an email to <a>cp2k+...@googlegroups.com</a>. >>> To post to this group, send email to <a>cp...@googlegroups.com</a>. >>> Visit this group at <a href="https://groups.google.com/group/cp2k" target="_blank" rel="nofollow" onmousedown="this.href='https://groups.google.com/group/cp2k';return true;" onclick="this.href='https://groups.google.com/group/cp2k';return true;">https://groups.google.com/group/cp2k</a> [2]. >>> For more options, visit <a href="https://groups.google.com/d/optout" target="_blank" rel="nofollow" onmousedown="this.href='https://groups.google.com/d/optout';return true;" onclick="this.href='https://groups.google.com/d/optout';return true;">https://groups.google.com/d/optout</a> [3]. > > -- > You received this message because you are subscribed to the Google > Groups "cp2k" group. > To unsubscribe from this group and stop receiving emails from it, send > an email to <a href="javascript:" target="_blank" gdf-obfuscated-mailto="or2v3iADBAAJ" rel="nofollow" onmousedown="this.href='javascript:';return true;" onclick="this.href='javascript:';return true;">cp2k+uns...@googlegroups.com</a>. > To post to this group, send email to <a href="javascript:" target="_blank" gdf-obfuscated-mailto="or2v3iADBAAJ" rel="nofollow" onmousedown="this.href='javascript:';return true;" onclick="this.href='javascript:';return true;">cp...@googlegroups.com</a>. > Visit this group at <a href="https://groups.google.com/group/cp2k" target="_blank" rel="nofollow" onmousedown="this.href='https://groups.google.com/group/cp2k';return true;" onclick="this.href='https://groups.google.com/group/cp2k';return true;">https://groups.google.com/group/cp2k</a>. > For more options, visit <a href="https://groups.google.com/d/optout" target="_blank" rel="nofollow" onmousedown="this.href='https://groups.google.com/d/optout';return true;" onclick="this.href='https://groups.google.com/d/optout';return true;">https://groups.google.com/d/optout</a>. > > > Links: > ------ > [1] > <a href="https://www.cp2k.org/howto:compile#l_elpa_optional_improved_performance_for_diagonalization" target="_blank" rel="nofollow" onmousedown="this.href='https://www.google.com/url?q\x3dhttps%3A%2F%2Fwww.cp2k.org%2Fhowto%3Acompile%23l_elpa_optional_improved_performance_for_diagonalization\x26sa\x3dD\x26sntz\x3d1\x26usg\x3dAFQjCNFJFILzobt9hWkKcn0p3Apwa4Povg';return true;" onclick="this.href='https://www.google.com/url?q\x3dhttps%3A%2F%2Fwww.cp2k.org%2Fhowto%3Acompile%23l_elpa_optional_improved_performance_for_diagonalization\x26sa\x3dD\x26sntz\x3d1\x26usg\x3dAFQjCNFJFILzobt9hWkKcn0p3Apwa4Povg';return true;">https://www.cp2k.org/howto:compile#l_elpa_optional_improved_performance_for_diagonalization</a> > [2] <a href="https://groups.google.com/group/cp2k" target="_blank" rel="nofollow" onmousedown="this.href='https://groups.google.com/group/cp2k';return true;" onclick="this.href='https://groups.google.com/group/cp2k';return true;">https://groups.google.com/group/cp2k</a> > [3] <a href="https://groups.google.com/d/optout" target="_blank" rel="nofollow" onmousedown="this.href='https://groups.google.com/d/optout';return true;" onclick="this.href='https://groups.google.com/d/optout';return true;">https://groups.google.com/d/optout</a> </blockquote></div></div>