Particle-in-cell (PIC) simulation is indispensable for modeling beam dynamics in particle accelerators, but its computational cost limits many-query workflows, such as configuration exploration, virtual diagnostics, and controller design. We introduce GLOBE, a physics-constrained Generative Latent Operator for Beam Evolution, modeling the nonlinear, control-dependent, multiscale evolution of 3D beam--field dynamics covering 107 spatial cells. GLOBE compresses beam--field states into a compact latent space and factors their evolution into two components. A control-conditioned neural operator learns the dominant dynamics, while an amplitude-normalized generative model captures the residual distribution, recovering fine-scale structures and conditional variations. GLOBE enforces field constraints by regime-specific, parameter-free operators: a Poisson solve reconstructs the electric field in the electrostatic regime, and a spectral projection imposes Gauss's law and a divergence-free magnetic field in the electromagnetic regime. On two high-resolution 3D particle-accelerator benchmarks, bunched-beam transport and plasma-wakefield acceleration, GLOBE lowers relative-L2 error by 9% and 13%, low-frequency spectral error by 69% and 51%, and mid-frequency spectral error by 54% and 20% relative to the strongest baseline (DPOT), satisfies field constraints, and reduces hours of PIC simulation to a minute per rollout.
Figures & tables
Figure 1: Framework Overview: The encoder Eψ compresses initial beam–field states u1:k into latent z1:k . At each rollout step t , the latest k latents zt−k+1:t and machine operation controls c are given to the latent dynamics models. The neural operator Gθ predicts the dominant evolution z~t+1:t+hdet and the flow-matching model Rξ samples the residual r~t+1:t+h . Their sum z~t+1:t+h is appended to the history and the prediction advances. Finally, Dψ reconstructs the mesh-resolved states and P enforces regime-specific field constraints.
Figure 2: Compressive Autoencoder : For each 3D input, every 2×2×2 block is split by the low-/high-pass pair (h,g) into 8 wavelet subbands, then the encoder Eψ compresses it to a grid latent z . The decoder Dψ mirrors the hierarchy, closing with the inverse Haar transform. Around every down-/up-sampling module, a parameter-free space–channel shortcut ( ⊕ ) provides references across resolution by channel averaging and duplication with reshaping, so the corresponding convolutional branch fits only a residual correction.
Bunched-Beam Transport
PWFA
Method
Params
Rel- L2↓
LF (low / mid / high) ↓
Time ↓
Params
Rel- L2↓
LF (low / mid / high) ↓
Time ↓
DPOT
91.4M
0.177
0.112 / 0.986 / 0.954
7.55 s
109.4M
0.224
0.156 / 0.377 / 0.634
3.04 s
UPT
92.6M
0.261
0.147 / 0.999 / 1.000
1384s
107.7M
0.378
0.251 / 0.640 / 2.585
114.5s
MPP
90.0M
0.347
0.384 / 0.991 / 0.978
943s
110.9M
0.325
0.443 / 1.279 / 3.212
73.5s
P3D-D
91.4M
0.329
0.197 / 0.961 / 2.160
91.3s
110.9M
0.520
0.314 / 0.789 / 19.3
17.9s
P3D-G
91.4M
0.490
0.437 / 0.323 / 1.115
1490s
111.0M
1.219
0.794 / 151 / 6002
309s
Table 1: Quantitative comparison of GLOBE and baselines on bunched-beam transport and PWFA.
Figure 3: Bunched-beam transport. Left: Transverse charge projection ∫ρdz , top: ground truth, bottom: one prediction sample from GLOBE-C. Right: Evolution of σx , σy , σz , and σx/σy . Due to rapid oscillation, the main curves of transverse quantities show period-wise extrema and the insets show frame-wise evolution. Prediction curve is the mean of eight GLOBE-C samples, and shading indicates the sample standard deviation.
Figure 4: PWFA. Left: longitudinal electric field Ez in the x – z mid-plane, overlaid with pseudo-particles of driver, witness, and plasma electrons sampled from charge density fields of WarpX (top) and GLOBE-C (bottom). First column is the last input frame; the rest show the forecast. Right: evolution of Ez,wit and rbubble .
Haar
Shortcut
Lrel↓
Lspec↓
Lfd↓
Runtime (s) ↓
✗
✗
0.0891
0.1070
0.697
6.04
✓
✗
0.0547
0.0740
0.566
0.97
✓
✓
0.0457
0.0685
0.489
1.00
Table 2: Ablation of two designs in our autoencoder: Haar transform (Haar) and multiscale resolution shortcut (Shortcut). The last row combines both designs and corresponds to the proposed autoencoder.
Rel- L2↓
∇⋅E−ρ/ε0↓
∇⋅B↓
w/o P
0.191
2.72×10−2
6.85×10−3
w/ P
0.194
2.77×10−7
2.78×10−7
Table 3: Ablation of the physics-constrained operator on PWFA. Constraint residuals are normalized RMS values averaged over frames and trajectories.
Bunched-Beam Transport
PWFA
Method
Rel- L2↓
LF↓
Rel- L2↓
LF↓
HFS
0.163
0.090 / 0.995 / 1.004
0.835
2.04 / 6.44 / 258
GLOBE-D (Ours)
0.144
0.039 / 0.994 / 1.003
0.174
0.083 / 0.350 / 0.592
HFS+DM
0.173
0.088 / 0.682 / 1.034
3.258
46.8 / 1301 / 2446
GLOBE-C (Ours)
0.161
0.035 / 0.457 / 0.973
0.194
0.077 / 0.300 / 0.618
Table 4: Ablation of latent Transformer backbone vs. HFS.
Appendix figures & tables32 assets
Supplementary material from the paper’s appendix.
Appendix
Figure 5: Visualization of the Transformer backbone used by deterministic neural operator Gθ and generative residual model Rξ .
Bunched-Beam Transport
PWFA
Method
Rel- L2↓
LF (low / mid / high) ↓
Rel- L2↓
LF (low / mid / high) ↓
GLOBE-D (no residual)
0.144
0.039 / 0.994 / 1.003
0.174
0.083 / 0.350 / 0.592
GLOBE-C ( σr only)
0.147
0.039 / 0.894 / 0.986
0.266
0.231 / 4.32 / 6.66
GLOBE-C (Ours)
0.161
0.035 / 0.457 / 0.973
0.194
0.077 / 0.300 / 0.618
Appendix
Table 5: Ablation of the amplitude normalization for the generative residual. GLOBE-C uses the factorized normalizer sω=σr⊙swin⊙stok ; the variant keeps only the global per-channel scale σr . GLOBE-D (deterministic anchor, no residual) is shown for reference.
Figure 6: Bunched-beam Transport Run 392: transverse beam evolution. Ground-truth and predicted density projections are shown together with the evolution of σx , σy , σz , and σx/σy .
Figure 7: Bunched-beam Transport Run 392: longitudinal beam evolution. Ground-truth and predicted longitudinal projections are compared over the rollout, with relative density errors shown below.
Figure 8: Bunched-beam Transport Run 392: fine-scale structure in the y=0 longitudinal slice. The deterministic prediction captures the bulk density evolution, while generative refinement recovers the realization-dependent mid-band structure observed in WarpX.
Figure 9: Bunched-beam Transport Run 244: transverse beam evolution. Ground-truth and predicted density projections are shown together with the evolution of σx , σy , σz , and σx/σy .
Figure 10: Bunched-beam Transport Run 244: longitudinal beam evolution. Ground-truth and predicted longitudinal projections are compared over the rollout, with relative density errors shown below.
Figure 11: Bunched-beam Transport Run 244: fine-scale structure in the y=0 longitudinal slice. The deterministic prediction captures the bulk density evolution, while generative refinement recovers the realization-dependent mid-band structure observed in WarpX.
Figure 12: Bunched-beam Transport Run 389: transverse beam evolution. Ground-truth and predicted density projections are shown together with the evolution of σx , σy , σz , and σx/σy .
Figure 13: Bunched-beam Transport Run 389: longitudinal beam evolution. Ground-truth and predicted longitudinal projections are compared over the rollout, with relative density errors shown below.
Figure 14: Bunched-beam Transport Run 389: fine-scale structure in the y=0 longitudinal slice. The deterministic prediction captures the bulk density evolution, while generative refinement recovers the realization-dependent mid-band structure observed in WarpX.
Figure 15: Bunched-beam Transport Run 87: transverse beam evolution. Ground-truth and predicted density projections are shown together with the evolution of σx , σy , σz , and σx/σy .
Figure 16: Bunched-beam Transport Run 87: longitudinal beam evolution. Ground-truth and predicted longitudinal projections are compared over the rollout, with relative density errors shown below.
Figure 17: Bunched-beam Transport Run 87: fine-scale structure in the y=0 longitudinal slice. The deterministic prediction captures the bulk density evolution, while generative refinement recovers the realization-dependent mid-band structure observed in WarpX.
Figure 18: Bunched-beam Transport Run 343: transverse beam evolution. Ground-truth and predicted density projections are shown together with the evolution of σx , σy , σz , and σx/σy .
Figure 19: Bunched-beam Transport Run 343: longitudinal beam evolution. Ground-truth and predicted longitudinal projections are compared over the rollout, with relative density errors shown below.
Figure 20: Bunched-beam Transport Run 343: fine-scale structure in the y=0 longitudinal slice. The deterministic prediction captures the bulk density evolution, while generative refinement recovers the realization-dependent mid-band structure observed in WarpX.
Figure 21: PWFA Run 312: wake evolution in the x – z plane together with trajectory-level observables. The color map shows Ez ; particles are overlaid by species. Right: predicted and reference observables with the ensemble sample deviation.
Figure 22: PWFA Run 312: detailed comparison at t=25 for representative field quantities. Left to right: ground truth, prediction, and error.
Figure 23: PWFA Run 312: relative-error maps for representative channels at selected times. Colors show (prediction−truth)/max∣truth∣ .
Figure 24: PWFA Run 355: wake evolution in the x – z plane together with trajectory-level observables. The color map shows Ez ; particles are overlaid by species. Right: predicted and reference observables with the ensemble sample deviation.
Figure 25: PWFA Run 355: detailed comparison at t=25 for representative field quantities. Left to right: ground truth, prediction, and error.
Figure 26: PWFA Run 355: relative-error maps for representative channels at selected times. Colors show (prediction−truth)/max∣truth∣ .
Figure 27: PWFA Run 271: wake evolution in the x – z plane together with trajectory-level observables. The color map shows Ez ; particles are overlaid by species. Right: predicted and reference observables with the ensemble sample deviation.
Figure 28: PWFA Run 271: detailed comparison at t=25 for representative field quantities. Left to right: ground truth, prediction, and error.
Figure 29: PWFA Run 271: relative-error maps for representative channels at selected times. Colors show (prediction−truth)/max∣truth∣ .
Figure 30: PWFA Run 27: wake evolution in the x – z plane together with trajectory-level observables. The color map shows Ez ; particles are overlaid by species. Right: predicted and reference observables with the ensemble sample deviation.
Figure 31: PWFA Run 27: detailed comparison at t=25 for representative field quantities. Left to right: ground truth, prediction, and error.
Figure 32: PWFA Run 27: relative-error maps for representative channels at selected times. Colors show (prediction−truth)/max∣truth∣ .
Figure 33: PWFA Run 118: wake evolution in the x – z plane together with trajectory-level observables. The color map shows Ez ; particles are overlaid by species. Right: predicted and reference observables with the ensemble sample deviation.
Figure 34: PWFA Run 118: detailed comparison at t=25 for representative field quantities. Left to right: ground truth, prediction, and error.
Figure 35: PWFA Run 118: relative-error maps for representative channels at selected times. Colors show (prediction−truth)/max∣truth∣ .