Commit Graph

3892 Commits

Author SHA1 Message Date
febb381880 updates and corrections to building LAMMPS as a library and using the USER-QMMM package 2020-02-20 14:58:02 +01:00
dcd9b7c891 replace two tables with code-block sections 2020-02-20 02:12:32 -05:00
a5ab3b13c5 cleaner typesetting 2020-02-19 16:15:35 -05:00
75a43398d9 replace more "parsed-literal" with "code-block" in build docs 2020-02-19 16:11:42 -05:00
a9dc629489 replace non-printable ASCII characters 2020-02-19 15:34:58 -05:00
aa5b870f7e use "code-block" instead of "parsed-literal" 2020-02-19 15:32:58 -05:00
91ad19754c correct, expand, and clarify documentation for linking with LAMMPS as a library 2020-02-19 18:14:57 +01:00
012dce93a0 Update package build docs for building the USER-QMMM package 2020-02-18 15:12:31 +01:00
9c507e6b81 Update Packages_details.rst 2020-02-17 21:53:14 -07:00
ec887b37da Merge branch 'master' of https://github.com/lammps/lammps into bond/react-new-examples-and-package 2020-02-17 21:34:20 -07:00
fe6f6b3002 Merge pull request #1869 from akohlmey/doc-continued-refactoring
More documentation refactoring for embedding math expressions
2020-02-17 13:06:07 -05:00
f9bee338dd Merge pull request #1875 from akohlmey/collected-small-fixes
Collected small bug fixes and updates
2020-02-17 11:40:27 -05:00
f69c6196a0 Merge branch 'master' into doc-continued-refactoring
# Conflicts:
#	doc/src/compute_fep.rst
2020-02-17 17:37:10 +01:00
c8561ecef0 Merge pull request #1879 from akohlmey/user-plumed-update
Update USER-PLUMED to include support for version 2.6.0. Fix bug in API check
2020-02-17 11:32:10 -05:00
b30670d405 correct some grammar and style issues in describing using/building LAMMPS on windows 2020-02-17 10:27:57 +01:00
4a2f05d333 convert pair styles srp to tersoff 2020-02-16 13:42:37 -05:00
3f5bb96aed pair ufm to pair zbl 2020-02-15 16:47:32 -05:00
a508138510 convert wall fixes to embedded math 2020-02-15 12:13:32 -05:00
b25f781071 convert docs for more fixes 2020-02-15 11:35:21 -05:00
0e2604fc80 Convert documentation of compute_fep and pair_fep_soft to mathjax 2020-02-15 16:19:39 +01:00
fd8cd6faa5 typeset hyperdynamics fix docs with embedded math 2020-02-15 06:50:04 -05:00
b0de48e47f convert some more fixes 2020-02-15 02:31:50 -05:00
2de515c671 improve layout 2020-02-14 12:31:55 +01:00
74a2fd973b convert docs for fixes eos/cv, eos/table/rx, gcmc, grem, langevin/spin, lb/fluid 2020-02-14 12:27:55 +01:00
7b32b1e595 Update pair_body_rounded_polyhedron docs 2020-02-14 09:52:06 +01:00
b1493d651f Update pair_body_rounded_polygon docs 2020-02-14 09:44:03 +01:00
f70e39c366 update fix ave/correlate/long docs to include info about limitations in output options vs. ave/correlate 2020-02-14 09:30:06 +01:00
147d430a6d Update pair_body_nparticle docs 2020-02-14 09:27:55 +01:00
e339e1735d Update pair_beck docs 2020-02-14 09:19:32 +01:00
4cacc4701d update plumed support to include version 2.6.0. Fix bug in API check 2020-02-13 16:03:58 +01:00
cf67c16fcb Add openkim-models install instructions 2020-02-11 22:33:56 -06:00
bfaae6860e fix controller 2020-02-11 16:28:45 +01:00
e4a730d57a fix bond/react, box/relax, ehex 2020-02-11 16:14:00 +01:00
6d5c001b61 delete no longer used equations 2020-02-11 14:57:31 +01:00
440f3b9492 correct for typo in txt style markup 2020-02-11 14:54:54 +01:00
3314b4853e convert compute xrd to use embedded math 2020-02-11 11:26:29 +01:00
c8034d19c4 fix up remaining computes for embedded math and a few other issues 2020-02-10 16:21:19 -05:00
8f3c94f33b document new error message 2020-02-08 15:22:54 -05:00
e952bcb5ac Fix pdf build of pair_atm docs 2020-02-08 20:09:40 +01:00
86ebc8260e Update pair_atm docs 2020-02-08 19:24:27 +01:00
712dbe6acc Update pair_airebo docs 2020-02-08 19:07:54 +01:00
5bb28e9e84 Update pair_agni docs 2020-02-08 18:36:34 +01:00
01805cf6ce Update pair_adp 2020-02-08 18:09:19 +01:00
8c82c60f2f fix of style related issues 2020-02-07 13:29:05 -05:00
0204bf286b CNT package
The tubular potential model (TPM) force field for Carbon Nanotubes (CNTs) package.
2020-02-06 16:50:38 -05:00
db805bc009 first chunk of compute commands to be converted to use embedded math 2020-02-04 17:05:23 -05:00
301a662a1d cosmetic corrections 2020-02-03 13:41:50 -05:00
966bc626fc Merge pull request #1858 from akohlmey/fft-consistency
Improved consistency and thread support in FFTs
2020-02-03 11:14:16 -05:00
b71e41dc8a minor fixes 2020-02-03 10:48:04 -05:00
1827ce1d32 update dynamical_matrix docs 2020-02-03 09:01:31 -05:00