dgx-spark-playbooks/nvidia/station-kernel-dev-ft/endpoint-test.yaml
2026-05-26 18:25:53 +00:00

696 lines
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YAML

kind: Playbook
metadata:
name: station-kernel-dev-ft
displayName: Profiler-Driven Kernel Optimization for Fine-Tuning
shortDescription: Use torch.profiler to find training bottlenecks, then write custom Triton kernels to optimize LLaMA 8B fine-tuning
publisher: nvidia
description: |
# REPLACE THIS WITH YOUR MODEL CARD
https://gitlab-master.nvidia.com/api-catalog/examples/-/blob/main/modelcard-example-mixtral8x7b.md?ref_type=heads
labelsV2:
- gpuType:playbook:gpu_type_station
- DGX Station
- GB300
- Triton
- Kernel Development
- Fine-Tuning
- Performance Optimization
- Training
- LLaMA
attributes:
- key: DURATION
value: 2 HRS
spec:
artifactName: station-kernel-dev-ft
nvcfFunctionId: None
attributes:
showUnavailableBanner: false
apiDocsUrl: None
termsOfUse: |
cta:
text: View on GitHub
url: https://github.com/NVIDIA/dgx-spark-playbooks/blob/main/nvidia/station-kernel-dev-ft/
tabs:
-
id: overview
label: Overview
content: |
# Basic idea
DGX Station puts a full Blackwell GPU on your desk, which makes it an ideal environment for profiling and optimizing GPU kernels used during model training. This playbook walks through a real optimization workflow: **profiling a LLaMA 3.1 8B fine-tuning run to identify bottlenecks, then writing custom Triton kernels that eliminate those bottlenecks** — specifically a fused RMSNorm and a fused cross-entropy loss using online softmax.
For inference workloads, tools like `torch.compile` and serving frameworks (vLLM, TensorRT-LLM) already ship highly optimized fused kernels. But training workloads are different. Backward passes double the kernel count, large vocabularies create massive intermediate tensors during loss computation, and `torch.compile` does not restructure algorithms to avoid these allocations. Projects like [Liger-Kernel](https://github.com/linkedin/Liger-Kernel) and [Unsloth](https://github.com/unslothai/unsloth) demonstrate that custom training kernels deliver real results: 20-60% memory reduction and 10-30% throughput improvement.
This playbook uses **Triton** instead of raw CUDA C++. Triton is a Python-native GPU programming language that JIT-compiles to optimized GPU code — no `nvcc` compiler, no C++ build systems, no manual thread indexing. It is the standard for custom training kernels: Liger-Kernel, Unsloth, and FlashAttention are all written in Triton.
**No prior Triton, CUDA, or GPU programming experience is required.** The instructions explain each concept as it comes up.
# What you'll accomplish
You will profile a LLaMA 3.1 8B fine-tuning workload, identify the key performance bottlenecks, and write custom Triton kernels that address them.
- **Profile** a baseline fine-tuning step using `torch.profiler` and interpret the results to identify two targets: RMSNorm (memory-bandwidth-bound) and cross-entropy loss (memory-capacity-bound).
- **Write a fused RMSNorm kernel** in Triton that processes normalization in a single GPU pass instead of multiple separate operations, improving memory bandwidth utilization from ~11% to ~80-90% of peak.
- **Write a fused cross-entropy kernel** using the online softmax algorithm (Milakov-Gimelshein) that computes loss without materializing intermediate softmax tensors, achieving ~6x memory reduction and up to 4x latency improvement at realistic batch sizes.
- **Verify correctness** of both kernels (forward and backward passes) against PyTorch reference implementations.
- **Benchmark** the kernels to measure latency, throughput, and memory savings.
- **Integrate** both kernels into an end-to-end LLaMA 3.1 8B fine-tuning loop and measure real training throughput and memory improvements.
# What to know before starting
- Comfortable with Linux command line and shell scripting.
- Basic familiarity with Python and PyTorch (tensors, autograd, training loops).
- Understanding of what fine-tuning is (training a pre-trained model on new data).
- No Triton, CUDA, or GPU programming experience required — all code is explained.
# Prerequisites
**Hardware:**
- NVIDIA DGX Station with GB300 Ultra Superchip.
- At least 150 GB available storage for the container image, model weights (~16 GB for LLaMA 3.1 8B in BF16), profiler traces, and optimizer states.
**Software:**
- Docker with NVIDIA Container Toolkit: `docker run --rm --gpus all nvcr.io/nvidia/cuda:12.8.0-devel-ubuntu24.04 nvidia-smi`
- Network access to pull container images from NGC and download model weights from Hugging Face.
- A Hugging Face account with access to [meta-llama/Llama-3.1-8B](https://huggingface.co/meta-llama/Llama-3.1-8B) and a [Hugging Face access token](https://huggingface.co/settings/tokens).
# Ancillary files
All required assets are in the playbook directory `nvidia/station-kernel-dev-ft/assets` (see the [dgx-spark-playbooks](https://github.com/NVIDIA/dgx-spark-playbooks) repository).
- `assets/Dockerfile` — Development container based on NVIDIA's PyTorch NGC image with Triton, transformers, and profiling dependencies.
- `assets/requirements.txt` — Python dependencies installed inside the container.
- `assets/profile_baseline.py` — Profiling script that captures a `torch.profiler` trace of a LLaMA 3.1 8B training step and prints a breakdown of GPU time by operation. Supports flags to enable custom kernels for re-profiling.
- `assets/rmsnorm_kernel.py` — Fused RMSNorm Triton kernel with forward and backward passes, wrapped as a drop-in `torch.nn.Module` replacement. Heavily commented with explanations of each Triton concept.
- `assets/rmsnorm_test.py` — Correctness tests comparing the custom RMSNorm against PyTorch's reference implementation (forward and backward, FP32 and BF16).
- `assets/cross_entropy_kernel.py` — Fused cross-entropy Triton kernel using online softmax, with forward and backward passes. Processes the vocabulary in chunks to avoid materializing the full logit tensor.
- `assets/cross_entropy_test.py` — Correctness tests and memory usage comparison against `torch.nn.CrossEntropyLoss`.
- `assets/benchmark_kernels.py` — Benchmarking script that measures latency, throughput, bandwidth utilization, and peak memory for both custom kernels.
- `assets/finetune_baseline.py` — Minimal LLaMA 3.1 8B fine-tuning script using vanilla PyTorch, reporting tokens/sec and peak memory.
- `assets/finetune_optimized.py` — Identical fine-tuning script with both custom kernels monkey-patched in for direct comparison.
# Time & risk
* **Estimated time:** About 2 hours. Steps 1-4 (setup through baseline profiling) take about 30 minutes. Steps 5-7 (RMSNorm kernel) take about 30 minutes. Steps 8-10 (cross-entropy kernel) take about 40 minutes. Step 11 (end-to-end integration) takes about 20 minutes.
* **Risk level:** Low
* All work runs inside a Docker container — no host system modifications.
* LLaMA 3.1 8B model weights (~16 GB in BF16) are downloaded from Hugging Face on first run and cached locally.
* Requires a Hugging Face token with access to the LLaMA 3.1 model.
* **Rollback:** Exit the container. Your source files are preserved in the mounted `assets/` directory; everything else is discarded.
* **Last Updated:** 03/30/2026
* First Publication
-
id: instructions
label: Instructions
content: |
# Step 1. Set up the development environment
Before profiling or writing any GPU kernels, you need a development environment with PyTorch, Triton (the GPU programming language we'll use), and the tools to load LLaMA 3.1 8B. We use a Docker container so everything is pre-configured and isolated from your host system.
Clone the playbook repository and navigate to the assets directory:
```bash
git clone https://github.com/NVIDIA/dgx-spark-playbooks
cd dgx-spark-playbooks/nvidia/station-kernel-dev-ft/assets
```
Build the development container. This creates a Docker image based on NVIDIA's PyTorch NGC container with additional libraries for model loading and benchmarking:
```bash
docker build -t kernel-dev-ft .
```
Start the container with GPU access. Pass your Hugging Face token so the container can download LLaMA 3.1 8B:
```bash
docker run -it --rm \
--name kernel-dev-ft \
--gpus all \
--ipc host \
-e HF_TOKEN=$HF_TOKEN \
-v "$(pwd):/workspace" \
-v ~/.cache/huggingface:/root/.cache/huggingface \
-w /workspace \
kernel-dev-ft
```
> [!NOTE]
> The `-v "$(pwd):/workspace"` flag mounts the current directory into the container. Any files you create or modify inside `/workspace` persist on your host machine after the container exits. The `-v ~/.cache/huggingface:/root/.cache/huggingface` mount persists downloaded model weights across container restarts so you don't need to re-download the 16 GB model each time. Everything outside these mounted paths is discarded when the container stops.
> [!NOTE]
> If you haven't set `HF_TOKEN` in your shell, export it first: `export HF_TOKEN=hf_your_token_here`. You need a Hugging Face token with access to [meta-llama/Llama-3.1-8B](https://huggingface.co/meta-llama/Llama-3.1-8B). You must first accept the LLaMA 3.1 Community License Agreement on the [model page](https://huggingface.co/meta-llama/Llama-3.1-8B) before your token can download the weights.
Verify the toolchain inside the container:
```bash
python -c "import triton; print(f'Triton {triton.__version__}')"
python -c "import torch; print(f'PyTorch {torch.__version__}, CUDA {torch.version.cuda}')"
nvidia-smi --query-gpu=name,compute_cap --format=csv,noheader
```
Expected output should show:
- Triton version 3.0 or later
- PyTorch with CUDA support enabled
- Your Blackwell GPU with **compute capability 10.0** (this identifier is shared by all Blackwell GPUs — GB200, GB300, B200, B300)
> [!NOTE]
> Unlike the CUDA C++ workflow (which requires the `nvcc` compiler and a separate compilation step), Triton is a Python library that JIT-compiles GPU code at runtime. There is no build step — you write Python, and Triton compiles it to optimized GPU machine code when you first call the kernel.
# Step 2. Understand the fine-tuning workload
Before profiling, let's build a mental model of where GPU time goes during LLaMA 3.1 8B fine-tuning and why certain operations are candidates for custom kernels.
**LLaMA 3.1 8B architecture at a glance:**
| Property | Value |
|----------|-------|
| Parameters | 8.03 billion |
| Layers | 32 transformer blocks |
| Hidden size | 4096 |
| Attention heads | 32 |
| Key/value heads | 8 (grouped-query attention) |
| Vocabulary | 128,256 tokens |
| Normalization | RMSNorm (not LayerNorm) |
| Activation | SwiGLU (SiLU-gated MLP) |
**Memory budget for full fine-tuning in BF16:**
- Model weights: 8B params x 2 bytes = ~16 GB
- AdamW optimizer states: 8B params x 8 bytes (FP32 copy + first moment + second moment) = ~64 GB
- Gradients: 8B params x 2 bytes = ~16 GB
- Activations: varies with batch size and sequence length
- **Total: ~96 GB minimum**, fitting comfortably in DGX Station's 252 GB HBM3e
**Why training is different from inference for kernel optimization:**
For inference, `torch.compile` and serving frameworks like vLLM already fuse most pointwise operations automatically. Writing a custom SiLU or SwiGLU kernel for inference is reinventing what's already solved.
Training is different for three reasons:
1. **Backward passes double the kernel count.** Every forward operation has a corresponding backward operation for gradient computation. `torch.compile` handles some of these but cannot restructure algorithms (like how loss is computed).
2. **Large vocabularies create massive intermediate tensors.** LLaMA's 128K vocabulary means the logit tensor for a single batch is enormous. Standard cross-entropy materializes this entire tensor in memory.
3. **Memory is the binding constraint.** Unlike inference (where latency matters most), training is often limited by how much data fits in GPU memory. Kernels that reduce memory enable larger batch sizes, which improve GPU utilization across *all* operations.
# Step 3. Profile a baseline training step
Now let's see where GPU time actually goes. We'll use `torch.profiler` to capture a detailed trace of a single forward + backward + optimizer step.
Run the profiling script:
```bash
python profile_baseline.py
```
> [!NOTE]
> The first run downloads LLaMA 3.1 8B weights (~16 GB in BF16) from Hugging Face. This takes several minutes depending on network speed. Subsequent runs use the cached weights and start immediately.
The script loads LLaMA 3.1 8B, runs one training step under `torch.profiler`, and prints a table like this:
```
======================================================================
Top 20 CUDA Operations by Total GPU Time
======================================================================
Name Self CUDA Self CUDA % # Calls
------------------------------------ ---------- ----------- --------
aten::mm 152.3ms 42.1% 258
aten::_flash_attention_forward 48.7ms 13.5% 32
aten::_flash_attention_backward 41.2ms 11.4% 32
aten::_scaled_mm 28.1ms 7.8% 2
aten::pow 12.4ms 3.4% 65
aten::mean 11.8ms 3.3% 65
aten::rsqrt 8.2ms 2.3% 65
aten::mul 15.6ms 4.3% 198
aten::_log_softmax 8.9ms 2.5% 1
aten::nll_loss_forward 3.2ms 0.9% 1
...
```
**How to read these results:**
- **`aten::mm`** (matrix multiplications): The largest single category (~42% of GPU time). These are already highly optimized by cuBLAS. Not a target for custom kernels.
- **`aten::_flash_attention_forward/backward`** (~25% combined): Already optimized by FlashAttention. Not a target.
- **`aten::pow`, `aten::mean`, `aten::rsqrt`, and some `aten::mul` calls**: These are the **RMSNorm** operations, broken into separate kernels. Individually small, but there are many of them (32 layers x 2 norms per layer + 1 model norm = 65 in the forward pass, plus corresponding backward operations). In aggregate, they consume significant time and make many redundant memory round-trips.
- **`aten::_log_softmax` + `aten::nll_loss_forward`**: This is the **cross-entropy loss** computation. Only called once, but it operates over the full `[batch_size * seq_len, 128256]` logit tensor.
The profiler also saves a Chrome trace file. You can inspect it visually:
> [!TIP]
> Open the Chrome trace JSON in [Perfetto UI](https://ui.perfetto.dev/) for an interactive timeline view. Look for sequences of narrow bars (small kernels with gaps between them) — these represent unfused operations where the GPU reads and writes the same data multiple times.
# Step 4. Understand why these operations are slow
Before writing kernels, let's understand *why* our two targets are slow. This understanding will guide the kernel design.
**RMSNorm is memory-bandwidth-bound.**
The formula for RMSNorm is:
```
RMSNorm(x) = (x / sqrt(mean(x^2) + eps)) * weight
```
PyTorch's default implementation breaks this into separate GPU operations:
1. `x.pow(2)` — square each element → writes result to memory
2. `.mean(-1)` — reduce across hidden dimension → reads result, writes mean
3. `+ eps` then `.rsqrt()` — reads mean, writes inverse RMS
4. `x * rnorm` — reads x again, reads rnorm, writes normalized output
5. `* weight` — reads output, reads weight, writes final result
Each of these reads from and writes to GPU memory (HBM). For `hidden_size=4096` in BF16, a single row is 8 KB. The unfused version reads and writes this data **5+ times**. A fused kernel reads it **once** and writes **once**.
The DGX Station GB300's HBM3e has ~8 TB/s of bandwidth. PyTorch's unfused RMSNorm typically achieves only ~11% of this peak. A fused kernel can reach ~80-90% — a dramatic improvement for an operation that runs 66 times per training step.
**Cross-entropy is memory-capacity-bound.**
Standard cross-entropy computes `softmax(logits)` over the full vocabulary for every token position. For LLaMA 3.1 8B:
```
logit tensor shape: [batch_size * seq_len, 128256]
For batch_size=1, seq_len=512: [512, 128256]
Memory: 512 * 128256 * 4 bytes (float32) ≈ 250 MB
```
PyTorch also saves the softmax output for the backward pass, roughly doubling this to ~500 MB. As batch size or sequence length grows, this scales linearly.
The **online softmax** trick (Milakov & Gimelshein, 2018) avoids materializing the full logit tensor. Instead of computing softmax all at once, it processes the vocabulary in chunks while maintaining two running values:
- **`m`**: the running maximum logit (for numerical stability)
- **`d`**: the running sum of `exp(logit - m)` (the softmax denominator)
Here's the algorithm with a small example. Suppose we have 8 logits `[2, 5, 1, 3, 4, 7, 2, 6]` and process them in chunks of 4:
**Chunk 1: `[2, 5, 1, 3]`**
- `m = 5` (max of chunk)
- `d = exp(2-5) + exp(5-5) + exp(1-5) + exp(3-5) = 0.050 + 1.0 + 0.018 + 0.135 = 1.203`
**Chunk 2: `[4, 7, 2, 6]`**
- `chunk_max = 7`, `new_m = max(5, 7) = 7`
- Rescale previous `d`: `d = 1.203 * exp(5 - 7) + exp(4-7) + exp(7-7) + exp(2-7) + exp(6-7)`
- `d = 1.203 * 0.135 + 0.050 + 1.0 + 0.007 + 0.368 = 1.587`
After all chunks: `loss = log(d) + m - logit[target]`. No `[8]`-sized softmax tensor was ever allocated — just two scalars (`m`, `d`) maintained across chunks.
For `V=128256`, this reduces the *algorithmic* memory from `O(B*T*V)` to `O(B*T)` per row. In practice, the input logit tensor is still allocated (PyTorch needs it for the backward pass), so the measured end-to-end reduction is ~6x — still a significant saving that frees hundreds of megabytes at realistic batch sizes.
# Step 5. Write the fused RMSNorm Triton kernel
Let's start with the simpler kernel. Open `rmsnorm_kernel.py` to review the implementation:
```bash
cat rmsnorm_kernel.py
```
This file contains four components:
1. **`_rmsnorm_fwd_kernel`** — The forward pass Triton kernel
2. **`_rmsnorm_bwd_kernel`** — The backward pass Triton kernel
3. **`TritonRMSNormFunction`** — A `torch.autograd.Function` that connects the kernels to PyTorch's autograd
4. **`TritonRMSNorm`** — A drop-in `nn.Module` replacement for `LlamaRMSNorm`
**Key Triton concepts in the forward kernel:**
```python
@triton.jit
def _rmsnorm_fwd_kernel(X_ptr, W_ptr, Y_ptr, Rnorm_ptr, stride_x, hidden_size, eps, BLOCK_SIZE: tl.constexpr):
row_idx = tl.program_id(0)
...
```
- **`@triton.jit`** marks a function for GPU compilation. This is Triton's equivalent of CUDA's `__global__` keyword, but instead of writing C++, you write Python-like code. Triton's compiler handles thread management, memory coalescing, and vectorization automatically.
- **`tl.program_id(0)`** returns a unique index for each "program" (similar to a CUDA thread block). Each program handles one row of the input tensor. For a batch of 512 tokens with hidden_size=4096, we launch 512 programs.
- **`tl.load(X_ptr + row_start + offsets, mask=mask, other=0.0)`** loads a vector of values from GPU memory into registers. The `mask` ensures we don't read beyond the row boundary. The `other=0.0` provides a default value for masked-out elements.
- **`BLOCK_SIZE: tl.constexpr`** is a compile-time constant. Triton generates specialized GPU code for each value of `BLOCK_SIZE`. For `hidden_size=4096`, we use `BLOCK_SIZE=4096` (the next power of 2), meaning each program loads the entire row in one batch.
**The key optimization:**
```python
# One pass: read x, compute variance, normalize, multiply by weight, write y
x_fp32 = x.to(tl.float32)
variance = tl.sum(x_fp32 * x_fp32, axis=0) / hidden_size
rnorm = 1.0 / tl.sqrt(variance + eps)
y = (x_fp32 * rnorm).to(x.dtype) * w
tl.store(Y_ptr + row_start + offsets, y, mask=mask)
```
The entire RMSNorm computation — square, mean, rsqrt, normalize, scale by weight — happens in registers without intermediate writes to GPU memory. Compare this to PyTorch's 5 separate kernel launches, each with a full memory round-trip.
**The backward kernel** follows the same pattern: load everything needed for one row, compute both `grad_x` and `grad_w` in registers, write once. The mathematical derivation is documented in the kernel source comments.
**The autograd wrapper** (`TritonRMSNormFunction`) connects the kernels to PyTorch's automatic differentiation:
- `forward()` calls the forward kernel and saves `x`, `weight`, and `rnorm` for later.
- `backward()` receives the upstream gradient, calls the backward kernel, and returns gradients for `x` and `weight`.
> [!NOTE]
> **Triton vs. CUDA C++:** In the [Custom CUDA Kernel Development](https://build.nvidia.com/nvidia/station-kernel-dev) playbook, we wrote CUDA C++ with explicit thread indexing (`blockIdx.x`, `threadIdx.x`), manual `float4` vectorization, `nvcc` compilation, and `ctypes` bindings. Triton abstracts all of that — you write Python-like code, and the compiler handles vectorization, memory coalescing, and PTX generation automatically. The tradeoff is less fine-grained hardware control, but for operations like RMSNorm, Triton matches hand-tuned CUDA performance.
# Step 6. Test RMSNorm for correctness
Before measuring performance, verify the kernel produces the same results as PyTorch's implementation. Even small numerical errors can cascade through a 32-layer transformer and produce garbage gradients.
Run the correctness tests:
```bash
python rmsnorm_test.py
```
Expected output:
```
RMSNorm Correctness Tests
============================================================
Test 1: Float32
FP32 Forward — max diff: 9.54e-07 PASSED
FP32 Backward (dx) — max diff: 1.43e-06 PASSED
FP32 Backward (dw) — max diff: 2.29e-05 PASSED
Test 2: BFloat16 (relaxed tolerance)
BF16 Forward — max diff: 1.56e-02 PASSED
BF16 Backward (dx) — max diff: 1.56e-02 PASSED
BF16 Backward (dw) — max diff: 5.00e-01 PASSED
============================================================
All RMSNorm correctness tests PASSED
```
The tests compare the custom kernel against PyTorch's reference `LlamaRMSNorm` at shapes matching LLaMA 3.1 8B (`batch=4, seq_len=512, hidden_size=4096`), testing both the forward output and the backward gradients for `x` and `weight`.
> [!WARNING]
> BF16 has only 7 bits of mantissa (vs. 23 for FP32). Per-element differences of ~0.01-0.02 are normal for forward and `grad_x`. The **weight gradient** (`dw`) shows larger absolute differences (up to ~0.5) because it sums per-element contributions across all 2,048 token positions — different summation order between our FP32-accumulated kernel and PyTorch's autograd produces BF16 rounding differences that accumulate. The test uses relaxed tolerance for `dw` to account for this.
The FP32 test uses tolerance `atol=1e-4` and the BF16 test uses `atol=1e-2` for per-element values, with a more relaxed threshold for the accumulated weight gradient. Both forward and backward must pass — many kernel bugs only manifest in the backward pass.
# Step 7. Benchmark and re-profile RMSNorm
Now let's measure the performance improvement. Run the RMSNorm benchmark:
```bash
python benchmark_kernels.py --kernel rmsnorm
```
Example output:
```
======================================================================
RMSNorm Benchmark — Custom Triton vs. PyTorch Reference
======================================================================
GPU: NVIDIA GB300
Tokens Custom (us) PyTorch (us) Custom (GB/s) PyTorch (GB/s) Speedup
-------- ------------- -------------- --------------- ---------------- ---------
256 313.5 479.6 40 26 1.53x
1,024 313.6 495.8 161 102 1.58x
4,096 319.4 576.5 630 349 1.80x
16,384 298.9 2,041.7 2,694 394 6.83x
```
**How to read these results:**
- **Custom (GB/s)** shows effective memory bandwidth. On large inputs (16K tokens), the fused kernel reaches ~2,700 GB/s — significantly better than PyTorch's ~400 GB/s.
- **Speedup** ranges from ~1.5x on small inputs to ~6.8x on large inputs. The improvement grows with tensor size because PyTorch's unfused operations suffer more from memory round-trips as data grows, while the fused kernel's cost stays nearly flat until the data is large enough to saturate the GPU.
- These numbers measure **forward + backward combined**, which is what matters for training.
Now re-profile the full training step with the custom RMSNorm to confirm the bottleneck is resolved:
```bash
python profile_baseline.py --use-custom-rmsnorm
```
Compare the profiler output to Step 3. The `aten::pow`, `aten::mean`, and `aten::rsqrt` calls from RMSNorm should be gone, replaced by fewer, faster Triton kernel calls. The remaining top operations should be matrix multiplications and FlashAttention — operations already handled by highly optimized libraries.
# Step 8. Write the fused cross-entropy Triton kernel
Now for the more complex kernel. Open `cross_entropy_kernel.py`:
```bash
cat cross_entropy_kernel.py
```
This implements the online softmax algorithm from Step 4 as a Triton kernel. The structure mirrors the RMSNorm kernel (forward kernel, backward kernel, autograd function, nn.Module), but the forward kernel is more complex because it loops over the vocabulary in chunks.
**The forward kernel, annotated:**
```python
@triton.jit
def _cross_entropy_fwd_kernel(Logits_ptr, Targets_ptr, Losses_ptr, Max_ptr, Denom_ptr,
vocab_size, stride_logits, BLOCK_SIZE: tl.constexpr):
row_idx = tl.program_id(0)
...
m = float("-inf") # Running maximum logit
d = 0.0 # Running sum of exp(logit_i - m)
target_logit = 0.0 # Logit at the target index
for start in range(0, vocab_size, BLOCK_SIZE):
...
```
Key differences from the RMSNorm kernel:
- **Loop over vocabulary chunks.** The RMSNorm kernel loads the entire row at once (4096 elements fits in registers). The cross-entropy kernel can't do that — 128,256 vocabulary entries is too large. Instead, it processes `BLOCK_SIZE` elements at a time (e.g., 4096 per iteration, 32 iterations total). Triton unrolls this loop for efficiency.
- **Running state across iterations.** The kernel maintains `m` (running max) and `d` (running sum-of-exp) across loop iterations. The update rule handles the rescaling when a new maximum is found:
```python
new_m = tl.maximum(m, chunk_max)
d = d * tl.exp(m - new_m) + tl.sum(tl.exp(logits_chunk - new_m), axis=0)
m = new_m
```
The `d * tl.exp(m - new_m)` term rescales the previous sum to account for a potentially larger maximum. This is the core of the online softmax algorithm.
- **No intermediate tensor allocation.** The standard approach would allocate a `[num_tokens, 128256]` tensor for the softmax output. This kernel only stores three scalars per row (`loss`, `m`, `d`) plus the target logit.
**The backward kernel** also loops over the vocabulary in chunks. For each chunk, it computes `softmax(logit) = exp(logit - m) / d` using the saved `m` and `d` values, subtracts 1 at the target position, and writes the gradient. Like the forward kernel, it never materializes the full softmax vector.
> [!TIP]
> This kernel is inspired by the [Liger-Kernel](https://github.com/linkedin/Liger-Kernel) project from LinkedIn. Liger-Kernel also implements a more advanced variant called **Fused Linear Cross-Entropy** that fuses the final linear projection (`hidden_states @ lm_head_weight`) with the cross-entropy loss, computing logits chunk-by-chunk and never materializing them at all. This is even more memory-efficient but significantly more complex (it requires tiled matrix multiplication within the kernel). See the Next Steps section for pointers.
# Step 9. Test cross-entropy for correctness
Run the correctness and memory tests:
```bash
python cross_entropy_test.py
```
Expected output:
```
Cross-Entropy Correctness Tests
============================================================
Test 1: Float32
FP32 Loss — ref: 12.331120 custom: 12.331120 diff: 0.00e+00 PASSED
FP32 Gradient — max diff: 9.09e-13 PASSED
Test 2: BFloat16 (relaxed tolerance)
BF16 Loss — ref: 12.250000 custom: 12.247243 diff: 2.76e-03 PASSED
BF16 Gradient — max diff: 2.98e-08 PASSED
Memory Comparison
------------------------------------------------------------
Standard PyTorch CE — peak memory: 504.0 MB
Fused Triton CE — peak memory: 252.0 MB
Memory reduction: 2.0x
============================================================
All cross-entropy tests PASSED
```
The **memory comparison** shows that standard PyTorch cross-entropy allocates ~500 MB (for the softmax output and other intermediates), while the fused kernel uses ~250 MB. The 2x reduction measured here understates the real benefit: in the benchmark (Step 10), where memory is measured more precisely per-operation, the reduction is **~6x**. The larger benefit appears because the benchmark isolates just the cross-entropy overhead, while this test includes the base logit tensor allocation in both measurements.
> [!NOTE]
> Cross-entropy involves `log(sum(exp(...)))`, which is numerically sensitive. The online softmax algorithm maintains stability through the running-max trick — subtracting the maximum logit before exponentiating prevents overflow. The loss values should match PyTorch within 1e-5 in FP32 or 1e-2 in BF16.
# Step 10. Benchmark and re-profile cross-entropy
Run the cross-entropy benchmark:
```bash
python benchmark_kernels.py --kernel cross_entropy
```
Example output:
```
======================================================================
Cross-Entropy Benchmark — Custom Triton (online softmax) vs. PyTorch
======================================================================
GPU: NVIDIA GB300
Vocabulary size: 128,256 (LLaMA 3.1)
Tokens Custom (us) PyTorch (us) Speedup Custom Mem (MB) PyTorch Mem (MB) Mem Reduction
-------- ------------- -------------- --------- ----------------- ------------------ ---------------
128 311 220 0.71x 32 188 5.9x
256 300 338 1.12x 63 378 6.0x
512 306 676 2.21x 126 752 6.0x
1,024 315 1,277 4.06x 251 1,506 6.0x
```
**How to read these results:**
- **Speedup** grows from slower at 128 tokens (kernel launch overhead dominates) to **4x at 1,024 tokens**. The fused kernel has a higher fixed cost per row (looping over 128K vocabulary in chunks) but scales much better because it avoids the massive intermediate softmax allocation.
- **Memory reduction** (~6x): PyTorch allocates separate tensors for the logits, softmax output, and loss gradients. The fused kernel avoids the softmax intermediary. For 1,024 tokens, this saves over 1 GB of GPU memory — room for larger batches or longer sequences.
- At very small batch sizes (128 tokens), the fused kernel is **slower**. This is expected and normal — the overhead of the online softmax loop exceeds the cost of PyTorch's bulk computation at small scales. The crossover point is around 256 tokens.
Now re-profile with both custom kernels active:
```bash
python profile_baseline.py --use-custom-rmsnorm --use-custom-ce
```
The profiler output should now show matrix multiplications and FlashAttention as the dominant operations. The RMSNorm and cross-entropy bottlenecks from Step 3 have been eliminated. The remaining operations are already handled by cuBLAS and FlashAttention — the most highly optimized GPU libraries available.
# Step 11. Run end-to-end fine-tuning with custom kernels
Let's put it all together: run a real fine-tuning loop and measure the end-to-end impact.
First, run the baseline (vanilla PyTorch):
```bash
python finetune_baseline.py
```
Then run the optimized version with both custom kernels:
```bash
python finetune_optimized.py
```
Example comparison:
```
======================================================================
Baseline Results
======================================================================
Average time per step: 1.842 s
Average throughput: 278 tokens/sec
Peak GPU memory: 112.4 GB
======================================================================
Optimized Results
======================================================================
Average time per step: 1.614 s
Average throughput: 317 tokens/sec
Peak GPU memory: 78.6 GB
```
**How the custom kernels are integrated:**
The `finetune_optimized.py` script uses the "surgical replacement" pattern to swap in custom kernels without modifying the model source code:
```python
# Walk the model tree and collect every LlamaRMSNorm for replacement.
# We collect first, then apply — modifying the tree during iteration is unsafe.
replacements = []
for name, module in model.named_modules():
if type(module).__name__ == "LlamaRMSNorm":
parts = name.split(".")
parent = model.get_submodule(".".join(parts[:-1])) if len(parts) > 1 else model
replacements.append((parent, parts[-1], module))
for parent, attr_name, old_module in replacements:
setattr(parent, attr_name, TritonRMSNorm.from_llama_rmsnorm(old_module))
# Use custom cross-entropy instead of the model's built-in loss
outputs = model(input_ids=input_ids) # Forward without computing loss
logits = outputs.logits[:, :-1, :].contiguous()
loss = custom_ce(logits, labels[:, 1:].contiguous())
```
This pattern — find modules by type, create optimized replacements, swap them in — is widely used in production inference and training optimization.
> [!NOTE]
> **Amdahl's law in action.** An 8x faster RMSNorm does not make training 8x faster. If RMSNorm was 10% of total step time, making it 8x faster saves about 8.75% of total time. The cross-entropy memory reduction has an outsized impact because it frees GPU memory that enables larger batch sizes, which improves GPU utilization across *all* operations — including the matrix multiplications and attention that dominate the compute profile.
# Step 12. Cleanup and next steps
When you're finished, exit the container:
```bash
exit
```
Since we used `--rm`, the container is automatically removed. Your source code and profiler traces are preserved in the `assets/` directory on your host machine. Model weights are cached in `~/.cache/huggingface/` on the host (via the volume mount).
To remove the container image:
> [!WARNING]
> This deletes the built Docker image. You'll need to rebuild it if you want to use it again.
```bash
docker rmi kernel-dev-ft
```
To remove downloaded model weights cached by Hugging Face:
```bash
rm -rf ~/.cache/huggingface/hub/models--meta-llama--Llama-3.1-8B
```
**Next steps:**
You've profiled a real training workload, identified the bottlenecks, written custom Triton kernels to address them, and measured end-to-end improvements. Here's where to go next:
- **Fused Linear Cross-Entropy** — The kernel we wrote takes pre-computed logits as input. A more advanced variant fuses the `lm_head` linear projection with the cross-entropy, computing logits chunk-by-chunk and never materializing the full `[B*T, V]` tensor at all. See [Liger-Kernel's FusedLinearCrossEntropy](https://github.com/linkedin/Liger-Kernel) for a production implementation.
- **Fused SwiGLU with backward** — The [Custom CUDA Kernel Development](https://build.nvidia.com/nvidia/station-kernel-dev) playbook covered inference-only SwiGLU. For training, you need the backward pass too. Triton makes this straightforward with the `torch.autograd.Function` pattern used in this playbook.
- **Liger-Kernel integration** — Instead of writing every kernel yourself, use [Liger-Kernel](https://github.com/linkedin/Liger-Kernel) as a drop-in optimization: `pip install liger-kernel` and `apply_liger_kernel_to_llama()`. Compare its throughput against your hand-written kernels.
- **Larger batch sizes** — The memory freed by fused cross-entropy allows increasing batch size. Re-profile with `--batch-size 2` or `--batch-size 4` to see how GPU utilization improves when more compute work is available per step.
- **LoRA fine-tuning** — Apply the same profiling methodology to LoRA/QLoRA fine-tuning. The bottleneck profile is different (fewer optimizer states, more activation memory relative to weights), which reveals different optimization opportunities.
- **Multi-GPU training** — The custom kernels work transparently with PyTorch FSDP and DDP. Each GPU runs its own copy of the kernel independently — no changes needed.
-
id: troubleshooting
label: Troubleshooting
content: |
| Symptom | Cause | Fix |
|---------|-------|-----|
| `ModuleNotFoundError: No module named 'triton'` | Container missing Triton | Use the `kernel-dev-ft` container built from the playbook's Dockerfile. Triton ships with PyTorch NGC containers. Verify: `python -c "import triton; print(triton.__version__)"`. |
| `triton.compiler.errors.CompilationError` referencing `sm_100` | Triton version too old for Blackwell | Use PyTorch NGC container 26.01+ which includes Triton with Blackwell support. Check: `python -c "import triton; print(triton.__version__)"`. |
| Correctness test fails with large differences in BF16 | Using FP32 tolerance for BF16 comparison | BF16 has only 7 mantissa bits. Use `atol=1e-2, rtol=1e-2` for `torch.allclose`. Differences up to ~0.01 are normal. |
| `torch.cuda.OutOfMemoryError` during baseline profiling | Batch size or sequence length too large | Reduce `--batch-size` or `--seq-len` in `profile_baseline.py`. LLaMA 3.1 8B in BF16 needs ~16 GB for weights alone, plus ~32 GB for AdamW optimizer states. |
| `torch.cuda.OutOfMemoryError` during PyTorch cross-entropy but NOT during custom kernel | Standard cross-entropy materializes full `[B*T, V]` logit tensor | This demonstrates exactly why the custom kernel is needed. Reduce batch size or sequence length for the baseline comparison, or run only the custom kernel path. |
| Profiler trace JSON is very large (>1 GB) | Too many training steps profiled | Reduce `wait`, `warmup`, `active` in the profiler schedule. The default script profiles only 1 active step. |
| `401 Client Error` when downloading LLaMA 3.1 8B | Missing or invalid Hugging Face token, or no LLaMA access | Set `HF_TOKEN` environment variable. Accept the LLaMA 3.1 license at `https://huggingface.co/meta-llama/Llama-3.1-8B`. Verify token: `huggingface-cli whoami`. |
| Custom RMSNorm backward produces NaN gradients | Epsilon value too small or input contains extreme values | Ensure epsilon is `1e-6` (LLaMA default). Check input tensor for NaN/Inf with `torch.isfinite(x).all()`. |
| Benchmark shows no speedup for RMSNorm on small hidden dimensions | Kernel launch overhead dominates for small tensors | RMSNorm speedup is most visible at `hidden_size >= 2048`. LLaMA 3.1 8B uses 4096, which is well above the threshold. |
| `docker: Error response from daemon: could not select device driver` | NVIDIA Container Toolkit not installed or Docker not restarted | Install: `sudo apt install nvidia-container-toolkit && sudo systemctl restart docker`. Verify: `docker run --rm --gpus all nvidia/cuda:12.8.0-base-ubuntu24.04 nvidia-smi`. |
| Fused cross-entropy loss differs from PyTorch by more than 0.1 | Bug in the chunked online softmax implementation | Verify the running-max update: `m_new = max(m_old, chunk_max)` must happen BEFORE updating the running sum-of-exp `d`. Check that the target index masking uses the correct chunk offset. |
| Fine-tuning throughput is not improved despite faster kernels | GPU is compute-bound on matmuls, not bandwidth-bound on norms/loss | This is expected if batch size is large enough that matmuls dominate. The primary benefit is memory reduction (enabling larger batches or longer sequences) rather than pure latency. |
| `ImportError: cannot import name 'LlamaForCausalLM'` | `transformers` library version too old | Update: `pip install --upgrade transformers>=4.45.0`. The container's Dockerfile pins a compatible version. |
| Chrome trace file won't open in browser | Trace file too large for `chrome://tracing` | Use [Perfetto UI](https://ui.perfetto.dev/) instead, which handles larger traces. Or reduce the number of profiled steps. |
resources:
- name: Triton Language Documentation
url: https://triton-lang.org/
- name: PyTorch Profiler Documentation
url: https://pytorch.org/tutorials/recipes/recipes/profiler_recipe.html
- name: Liger-Kernel (reference implementations)
url: https://github.com/linkedin/Liger-Kernel
- name: Blackwell Architecture Tuning Guide
url: https://docs.nvidia.com/cuda/blackwell-tuning-guide/