b936673935
consolidate calls to utils::errorurl() with corresponding error class calls.
2025-03-19 02:23:10 -04:00
0f10741f71
update tests for variable commands
2025-03-13 04:38:58 -04:00
33ac6c8836
address several issues related to variables and improve error messages
2025-03-12 22:33:07 -04:00
6d6fce7866
provide explanation for "variable evaluated before simulation box is defined"
2025-03-12 20:36:01 -04:00
800a5f6310
Merge pull request #4409 from willzunker/mdr-rebase2
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pair_style granular - MDR contact model
2025-01-28 16:33:27 -05:00
77e6a6dcef
Suppress compiler warning since return value can be safely ignored
2025-01-27 10:58:15 -07:00
72784262b1
Merge branch 'develop' into mdr-rebase2
2025-01-17 12:17:20 -07:00
fa54fd1097
add option to suppress printing the last command
2025-01-16 21:11:27 -05:00
4f6c3d12f7
avoid variable definition error: expected 3 arguments but found N
2025-01-10 20:10:53 -05:00
53c3fa2afd
memcpymask is a constant and thus should be uppercase
2024-12-27 01:54:44 -05:00
5ece81323e
suppress bogus compiler warnings about overflowing buffer size in memcpy()
2024-12-26 22:53:44 -05:00
64c06e9673
revert verlet.cpp change
2024-12-15 11:53:48 -08:00
e48f288e2b
result of "make fix-whitespace"
2024-12-14 13:20:16 -08:00
00ebe9a3e8
Squashed version of Will's commits.
2024-12-09 08:31:57 -08:00
4296db4991
add link with more explanation to the illegal variable errors
2024-11-20 11:15:12 -05:00
804aa4ee85
improve error message
2024-09-16 20:38:50 -04:00
0f792b0434
cast return value to void to indicate that we want to ignore the result
2024-08-13 12:36:43 -04:00
7e3d613c80
set to zero on underflow to avoid std::stod() throwing an out-of-range exception
2024-07-30 22:24:59 -04:00
a75862088a
replace atof() with std::stod()
2024-07-30 03:43:26 -04:00
f0e9d0c96d
update comment
2024-07-30 03:39:03 -04:00
361b8c25c4
use c++11 function to convert strings to numbers
2024-07-30 00:34:12 -04:00
58513320d3
core files: replace sprintf with snprintf
2024-07-13 15:33:56 -06:00
6ad0145709
new special variable function is_timeout()
2024-06-29 04:02:33 -04:00
118fa8e209
must reset "eval_in_progress[]" flags to avoid bogus circular dependency errors
2024-06-03 07:47:59 -04:00
3bc367e0b0
implement suggestions made by @rbberger
2024-05-25 05:00:08 -04:00
371ec2036f
support trailing brackets for sort() and rsort()
2024-05-23 01:24:41 -04:00
272ce64272
add special function for sorting vectors
2024-05-22 23:46:36 -04:00
5ffff255ea
simplify with STL classes
2024-05-22 23:46:13 -04:00
c1538c2f78
move varstyle array definition to Variable class so it can be used in a more general way
2024-05-22 23:42:56 -04:00
1346be4168
Merge pull request #4126 from lammps/global-vector-access
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Relax error check on accessing fixes that produce variable size vectors/arrays
2024-04-13 16:58:50 -04:00
9f88867b37
update parsing of file and atomfile variable files
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this allows to handle comments and empty lines everywhere for atomfile
and file variables and in a consistent manner since it used utils functions.
also error messages are improved and more specific.
2024-04-10 03:08:08 -04:00
af88cec22d
relax error check on fixes that produce variable size vectors/arrays
2024-04-05 15:12:46 -06:00
2c26586b1a
clean up
2024-04-04 13:50:43 -06:00
6a2bcc7258
merge in current develop
2024-04-04 13:30:14 -06:00
30f330718a
more consistent error checks on variable length global vecs and arrays
2024-03-29 16:53:18 -06:00
7137290682
Follow requested changes to patch
2024-03-29 21:52:57 +01:00
1b7bc36505
Fix variables compatibility with chunk arrays
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When using variables with chunk computes that produce arrays (such as `compute chunk/atom`) the compute will not have set `size_array_rows` to the appropriate value before it has ever been called and will therefore incorrectly have thrown the error "Variable formula compute array is zero length".
2024-03-10 12:56:33 +01:00
46cacf089e
whitespace
2024-02-19 21:41:29 -05:00
7a5fa7ca54
not a bug but change variable evaluate local ivar to jvar to avoid code confusion
2024-02-19 17:34:43 -07:00
d70a98561f
fix bug in removing a variable
2024-02-19 17:33:51 -07:00
6442e05988
even more define to static constexpr conversions
2024-01-25 02:17:28 -05:00
a6261d75b9
some more define to static constexpr conversions
2024-01-24 21:14:19 -05:00
12422ff510
replace defines with static constexpr declarations
2024-01-21 15:53:35 -05:00
9e1f85518c
avoid segfault with immediate variables
2023-11-27 05:31:12 -05:00
e3ba19c145
Merge branch 'develop' into variable-custom-atom-properties
2023-11-25 06:42:38 -05:00
dc32efe9be
whitespace
2023-11-23 16:19:43 -05:00
961cbfbe10
add custom atom property refs to variable syntax
2023-11-22 22:40:58 -07:00
0db826ae77
whitespace
2023-11-22 19:39:29 -05:00
eb6c101d94
add ternary math function
2023-11-22 09:49:11 -07:00
ea8234a875
treat immediate variables like equal style also for evaluating references to computes and fixes
2023-11-16 22:08:00 -05:00
