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ACEsuit
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ACE.jl
Parameterisation of Equivariant Properties of Particle Systems
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Multiple properties via SVectors
#98
cortner
closed
2 years ago
10
Multi-Property Models via Matrices
#97
cortner
closed
2 years ago
2
Revisit Multi-Property Management
#96
cortner
closed
2 years ago
16
Performance 2 - Linear Models
#95
andresrossb
closed
2 years ago
14
WIP: Performance-2 - Linear Models
#94
andresrossb
closed
2 years ago
3
WIP: Performance 1 - Fixing States and 1pBasis Implementations
#93
cortner
closed
2 years ago
8
Make SphericalTensors with constant hard-coded
#92
zhanglw0521
closed
2 years ago
0
Development branches of ACE don't support current version of JuLIP
#91
WillBaldwin0
closed
2 years ago
3
r0 has no effect if Polytransform used with multitransform
#90
WillBaldwin0
closed
2 years ago
3
State allocates
#89
cortner
closed
2 years ago
12
Forward-Port Species-Dependent Transforms
#88
cortner
closed
2 years ago
1
The property filters look like they may be broken?
#87
cortner
opened
2 years ago
0
The Constant (0-correlation)
#86
cortner
closed
2 years ago
13
Decision on ACE Arguments
#85
cortner
closed
2 years ago
2
SparseBasis Basis selector bug
#84
davkovacs
closed
2 years ago
8
Custom distance transform
#83
davkovacs
closed
2 years ago
4
quickstart not working
#82
bernstei
closed
2 years ago
4
Segfaults with ACE + J1.7
#81
cortner
opened
2 years ago
5
Constant term in ACE basis
#80
zhanglw0521
closed
2 years ago
2
Species dependent transforms for v0.8.x
#79
cortner
closed
2 years ago
32
ACE0.8.x Import Tests Fail on J 1.7
#78
cortner
closed
2 years ago
1
Element-pair dependant radial transform (r0)
#77
LarsSchaaf
closed
2 years ago
19
Self-adjointness debugging
#76
zhanglw0521
closed
2 years ago
0
Replace `degree` with `level` for basis selectors
#75
cortner
closed
2 years ago
3
Basis Selectors and Basis Constraints
#74
cortner
opened
2 years ago
1
Access Product 1p Basis Components
#73
cortner
closed
2 years ago
5
WIP: levels
#72
cortner
closed
2 years ago
0
Interface for Basis Specs
#71
cortner
closed
2 years ago
8
Fixing EuclideanVector
#70
cortner
closed
2 years ago
18
State vs Property
#69
cortner
opened
2 years ago
0
Proper implementation of scaling function
#68
cortner
opened
2 years ago
8
Basis selectors extended
#67
MatthiasSachs
closed
2 years ago
7
Fix and generalise the function `norm(X::XState)`
#66
zhanglw0521
closed
2 years ago
3
Degree and Basis Selector
#65
cortner
closed
2 years ago
6
Basis selectors restructured
#64
MatthiasSachs
closed
2 years ago
1
Typo in `function _gensparse(...)`
#63
MatthiasSachs
closed
2 years ago
2
WIP: old bug in basis filter emerging
#62
cortner
closed
2 years ago
6
Bug in ObjectPools
#61
cortner
closed
2 years ago
1
WIP: Partial Derivatives
#60
cortner
closed
2 years ago
1
basis selector added
#59
MatthiasSachs
closed
2 years ago
6
WIP: Generalise basis spec
#58
cortner
closed
2 years ago
0
m range in product basis
#57
cortner
closed
2 years ago
1
update and error fix to ellipsoid bonds
#56
MatthiasSachs
closed
2 years ago
2
WIP: Move bonds codes from old ACE
#55
cortner
closed
2 years ago
6
WIP: Generic Discrete 1p Basis
#54
cortner
closed
2 years ago
21
fixed adjoint_EVAL_D
#53
andresrossb
closed
2 years ago
8
same parameters v5 and v6 seem to produce different basis; explore what changed and fix if there are bugs (@cortner)
#52
cortner
closed
2 years ago
1
WIP: isrealB / AA interface
#51
cortner
closed
2 years ago
6
Simplified basis functions, Basis selectors
#50
cortner
closed
2 years ago
0
enable scaling function in ACE main branch
#49
zhanglw0521
closed
2 years ago
11
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