evaleev / libint

Libint: high-performance library for computing Gaussian integrals in quantum mechanics
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Build on PPC segfaults #260

Open barracuda156 opened 1 year ago

barracuda156 commented 1 year ago
make[3]: Entering directory `/opt/local/var/macports/build/_opt_PPCRosettaPorts_science_libint/libint/work/evaleev-libint-704f581/src/lib/libint'
cp -f /opt/local/var/macports/build/_opt_PPCRosettaPorts_science_libint/libint/work/libint-2.7.2/src/lib/libint/Makefile.library tmp/libint/Makefile
cd src; /opt/local/var/macports/build/_opt_PPCRosettaPorts_science_libint/libint/work/libint-2.7.2/src/lib/libint/../../../src/bin/libint/build_libint
build_libint(1393) malloc: *** error for object 0x8402c0: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
build_libint(1393) malloc: *** error for object 0x83f928: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
build_libint(1393) malloc: *** error for object 0x83f890: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
build_libint(1393) malloc: *** error for object 0x83f8dc: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
build_libint(1393) malloc: *** error for object 0x83f7c8: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
build_libint(1393) malloc: *** error for object 0x83f6a0: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
build_libint(1393) malloc: *** error for object 0x83f5c0: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
build_libint(1393) malloc: *** error for object 0x83f630: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
build_libint(1393) malloc: *** error for object 0x83f4f8: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
build_libint(1393) malloc: *** error for object 0x840200: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
build_libint(1393) malloc: *** error for object 0x840380: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
build_libint(1393) malloc: *** error for object 0x84038c: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
build_libint(1393) malloc: *** error for object 0x8403a8: pointer being freed was not allocated
*** set a breakpoint in malloc_error_break to debug
CompilationParameters::max_am: task=default max_am=4 center=0
CompilationParameters::max_am_opt: task=default max_am_opt=3
task=default center=0 lmax=4
task=default center=1 lmax=4
task=default center=2 lmax=4
task=default center=3 lmax=4
task=overlap center=0 lmax=4
task=overlap center=1 lmax=4
task=kinetic center=0 lmax=4
task=kinetic center=1 lmax=4
task=elecpot center=0 lmax=4
task=elecpot center=1 lmax=4
task=1emultipole center=0 lmax=4
task=1emultipole center=1 lmax=4
task=2emultipole center=0 lmax=4
task=2emultipole center=1 lmax=4
task=3emultipole center=0 lmax=4
task=3emultipole center=1 lmax=4
task=sphemultipole center=0 lmax=4
task=sphemultipole center=1 lmax=4
task=eri center=0 lmax=4
task=eri center=1 lmax=4
task=eri center=2 lmax=4
task=eri center=3 lmax=4
----------------------------------------------
 build_libint2: optimizing integrals compiler 
                        by Edward F. Valeev   
                and ideas by Justin Fermann   
                         and Curtis Janssen   
----------------------------------------------

Will support one-body integrals
Will support ERI
MAX_AM           = 4
OPT_AM           = 3
Task default:
  MAX_AM         = 4
  OPT_AM         = 3
  NUM_BF         = 4
Task overlap:
  MAX_AM         = 4
  OPT_AM         = 3
  NUM_BF         = 2
Task kinetic:
  MAX_AM         = 4
  OPT_AM         = 3
  NUM_BF         = 2
Task elecpot:
  MAX_AM         = 4
  OPT_AM         = 3
  NUM_BF         = 2
Task 1emultipole:
  MAX_AM         = 4
  OPT_AM         = 3
  NUM_BF         = 2
Task 2emultipole:
  MAX_AM         = 4
  OPT_AM         = 3
  NUM_BF         = 2
Task 3emultipole:
  MAX_AM         = 4
  OPT_AM         = 3
  NUM_BF         = 2
Task sphemultipole:
  MAX_AM         = 4
  OPT_AM         = 3
  NUM_BF         = 2
Task eri:
  MAX_AM         = 4
  OPT_AM         = 3
  NUM_BF         = 4
MAX_VECTOR_LENGTH    = 1
UNROLL_THRESH        = 100
SOURCE_DIRECTORY     = ./
API_PREFIX           = 
USE_C_LINKING        = true
COUNT_FLOPS          = false
PROFILE              = false
ACCUMULATE_TARGETS   = false
REALTYPE             = double
CONTRACTED_TARGETS   = true

working on _overlap_S_P ... /bin/sh: line 1:  1393 Segmentation fault      /opt/local/var/macports/build/_opt_PPCRosettaPorts_science_libint/libint/work/libint-2.7.2/src/lib/libint/../../../src/bin/libint/build_libint
make[3]: *** [tmp/libint/libint2_params.h] Error 139