Commit Graph

45 Commits

Author SHA1 Message Date
748046089c add another couple of dependent functions 2025-01-08 16:32:56 -05:00
f3425ebfbf add one more missing dependency 2025-01-08 16:21:08 -05:00
e7d9244184 add missing dependency 2025-01-08 16:14:28 -05:00
8ec9f37611 update linalg to version 1.4 corresponding to LAPACK 3.12.1 2025-01-08 15:52:30 -05:00
a1a2a54f72 update linalg for ML-QUIP 2024-11-09 04:14:11 -05:00
9f867b5f54 add LAPACK functions for matrix inversion via Cholesky decomposition 2024-09-18 19:13:37 -04:00
a8447b419d fix bug causing memory corruption and clean up lmp_f2c.h header 2024-08-18 21:34:15 -04:00
2a1af662d4 update to LAPACK 3.12 2023-11-24 15:29:14 -05:00
57790ef35f remove fortran sources and update README with pointer to the conversion package 2022-12-31 16:59:25 -05:00
57713cf9a3 remove redundant comments from generated C++ files. clean up with clang-format. 2022-12-28 16:44:38 -05:00
f157ba2389 add some f2c runtime functions, remove exception, avoid name conflict with libgfortran 2022-12-28 16:00:38 -05:00
1e8b2ad5a0 whitespace fixes 2022-12-28 13:48:43 -05:00
a894cbfbb7 update linalg README 2022-12-28 13:48:43 -05:00
119fae3b8c remove unused code 2022-12-28 13:48:43 -05:00
c5a87f75d6 convert linalg library from Fortran to C++ 2022-12-28 13:18:38 -05:00
7cceabe5bd ILAENV function does not use IPARAM2STAGE anymore 2022-12-28 12:17:49 -05:00
9b7b45bdea update lib/linalg README 2022-11-29 17:27:07 -05:00
d3bb55fa4f update BLAS/LAPACK to version 3.11.0 from 22 Nov 2022 2022-11-27 17:24:05 -05:00
5205e208a0 add DPOTSV and DPOTRS LAPACK functions 2022-11-27 17:18:23 -05:00
c8cc2b1b24 update to LAPACK version 3.10.1 2022-07-21 08:41:44 -04:00
bf65b4720f add more BLAS/LAPACK functions to support LATTE package 2022-07-21 05:20:11 -04:00
878795e64a bulk rename of remaining USER- packages 2021-06-29 20:12:59 -04:00
649a8cc01a Fix typo 2020-03-14 13:57:48 +09:00
8af9d40392 Update DOI resolver
https://www.doi.org/doi_handbook/2_Numbering.html#htmlencoding
2020-03-12 16:53:24 +09:00
af91f7fa5d LAMMPS does not build on windows without this one 2018-06-25 18:13:41 -04:00
fe483a769f update makefiles in lib/linalg to support .F files in addition to .f files 2018-06-15 15:35:34 -04:00
2e7b919774 linalg: update to netlib lapack-3.7.1 2018-05-18 15:20:47 -06:00
858c211fdc linalg: add functions needed for MSCG 2018-05-18 15:08:08 -06:00
d1630bbe34 add missing BLAS/LAPACK functions used by LATTE to linalg lib 2017-10-24 13:22:20 -04:00
8bba29d91e more lib installation cleanup 2017-08-07 17:21:45 -04:00
135b1650f1 revamp of library builds
- remove cross compiler stuff
- make use of Install.py consistent
- provide options for Makefile.serial and Makefile.mpi that match those in src
2017-08-07 17:13:01 -04:00
296e572e69 better Install.py script for KIM from Ryan Elliott 2017-07-14 16:25:16 -06:00
addd87c0f7 new Section package and start doc pages and build scripts 2017-05-04 11:22:20 -06:00
a3e05a2bac permission cleanup 2016-10-01 06:34:45 -04:00
b190abea39 sync with GH
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15561 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-09-08 20:20:32 +00:00
a79274aac4 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12663 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-30 15:22:01 +00:00
e954b14d99 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10198 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-06-29 21:23:34 +00:00
bfbe995a9c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10165 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-06-28 19:30:58 +00:00
4c5ae335d4 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9990 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-05-31 15:36:13 +00:00
2a70442035 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9989 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-05-31 15:35:54 +00:00
cf370d0ae7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9969 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-05-30 19:28:38 +00:00
23dea1868e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9955 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-05-30 17:23:53 +00:00
e19e06952f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8646 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-14 14:20:55 +00:00
062409ad34 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7445 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-06 18:15:19 +00:00
1215b8accc git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7435 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-06 17:41:26 +00:00