From 246f58670f62a959392a10f87f77aba0895b197a Mon Sep 17 00:00:00 2001 From: "Evan Walter Clark Spotte-Smith, PhD" Date: Thu, 24 Oct 2024 18:35:27 -0400 Subject: [PATCH] Change logo text color and make small paper and README changes in response to reviewer comments --- README.md | 8 +++++++- logo.png | Bin 19227 -> 25361 bytes paper.md | 3 +-- 3 files changed, 8 insertions(+), 3 deletions(-) diff --git a/README.md b/README.md index 8ab2c45..4530f3b 100644 --- a/README.md +++ b/README.md @@ -28,4 +28,10 @@ If you don't know where to start, you can check out the open [issues](https://gi Have a problem installing or running RNMC, or have an idea for how the code could be better? Need support in using RNMC? Please open a new issue, and label the issue (with *e.g.*, “bug”, “enhancement”, or “question”) so that we can triage appropriately. Issues are preferred over e-mails or other private communications because multiple users might encounter the same problem. -A more complete guide to contributing can be found in our [online documentation](https://blaugroup.github.io/RNMC/Contributors.html). \ No newline at end of file +A more complete guide to contributing can be found in our [online documentation](https://blaugroup.github.io/RNMC/Contributors.html). + +## Limitations + +In its current form, `RNMC` only allows reactions with up to two reactants and up to two products. Ternary and other n-ary reactions cannot be included in `RNMC` simulations, though this would be possible with modest modifications to the code. + +Reaction selection in kinetic Monte Carlo simulations can in principle be performed in $O(1)$ time (see Slepoy et al., *J. Chem. Phys.* **128**(205101) (2008). [DOI: 10.1063/1.2919546](https://doi.org/10.1063/1.2919546)). 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