perf: Fix near-miss penalty in _morton_order with hybrid ceiling+argsort strategy

src/zarr/core/indexing.py

@@ -1512,54 +1512,48 @@ def _morton_order(chunk_shape: tuple[int, ...]) -> npt.NDArray[np.intp]:
         out.flags.writeable = False
         return out
 
-    # Optimization: Remove singleton dimensions to enable magic number usage
-    # for shapes like (1,1,32,32,32). Compute Morton on squeezed shape, then expand.
-    singleton_dims = tuple(i for i, s in enumerate(chunk_shape) if s == 1)
-    if singleton_dims:
-        squeezed_shape = tuple(s for s in chunk_shape if s != 1)
-        if squeezed_shape:
-            # Compute Morton order on squeezed shape, then expand singleton dims (always 0)
-            squeezed_order = np.asarray(_morton_order(squeezed_shape))
-            out = np.zeros((n_total, n_dims), dtype=np.intp)
-            squeezed_col = 0
-            for full_col in range(n_dims):
-                if chunk_shape[full_col] != 1:
-                    out[:, full_col] = squeezed_order[:, squeezed_col]
-                    squeezed_col += 1
-        else:
-            # All dimensions are singletons, just return the single point
-            out = np.zeros((1, n_dims), dtype=np.intp)
-        out.flags.writeable = False
-        return out
-
-    # Find the largest power-of-2 hypercube that fits within chunk_shape.
-    # Within this hypercube, Morton codes are guaranteed to be in bounds.
-    min_dim = min(chunk_shape)
-    if min_dim >= 1:
-        power = min_dim.bit_length() - 1  # floor(log2(min_dim))
-        hypercube_size = 1 << power  # 2^power
-        n_hypercube = hypercube_size**n_dims
+    # Ceiling hypercube: smallest power-of-2 hypercube whose Morton codes span
+    # all valid coordinates in chunk_shape. (c-1).bit_length() gives the number
+    # of bits needed to index c values (0 for singleton dims). n_z = 2**total_bits
+    # is the size of this hypercube.
+    total_bits = sum((c - 1).bit_length() for c in chunk_shape)
+    n_z = 1 << total_bits if total_bits > 0 else 1
+
+    # Decode all Morton codes in the ceiling hypercube, then filter to valid coords.
+    # This is fully vectorized. For shapes with n_z >> n_total (e.g. (33,33,33):
+    # n_z=262144, n_total=35937), consider the argsort strategy below.
+    order: npt.NDArray[np.intp]
+    if n_z <= 4 * n_total:
+        # Ceiling strategy: decode all n_z codes vectorized, filter in-bounds.
+        # Works well when the overgeneration ratio n_z/n_total is small (≤4).
+        z_values = np.arange(n_z, dtype=np.intp)
+        all_coords = decode_morton_vectorized(z_values, chunk_shape)
+        shape_arr = np.array(chunk_shape, dtype=np.intp)
+        valid_mask = np.all(all_coords < shape_arr, axis=1)
+        order = all_coords[valid_mask]
     else:
-        n_hypercube = 0
+        # Argsort strategy: enumerate all n_total valid coordinates directly,
+        # encode each to a Morton code, then sort by code. Avoids the 8x or
+        # larger overgeneration penalty for near-miss shapes like (33,33,33).
+        # Cost: O(n_total * bits) encode + O(n_total log n_total) sort,
+        # vs O(n_z * bits) = O(8 * n_total * bits) for ceiling.
+        grids = np.meshgrid(*[np.arange(c, dtype=np.intp) for c in chunk_shape], indexing="ij")
+        all_coords = np.stack([g.ravel() for g in grids], axis=1)
+
+        # Encode all coordinates to Morton codes (vectorized).
+        bits_per_dim = tuple((c - 1).bit_length() for c in chunk_shape)
+        max_coord_bits = max(bits_per_dim)
+        z_codes = np.zeros(n_total, dtype=np.intp)
+        output_bit = 0
+        for coord_bit in range(max_coord_bits):
+            for dim in range(n_dims):
+                if coord_bit < bits_per_dim[dim]:
+                    z_codes |= ((all_coords[:, dim] >> coord_bit) & 1) << output_bit
+                    output_bit += 1
+
+        sort_idx: npt.NDArray[np.intp] = np.argsort(z_codes, kind="stable")
+        order = np.asarray(all_coords[sort_idx], dtype=np.intp)
 
-    # Within the hypercube, no bounds checking needed - use vectorized decoding
-    if n_hypercube > 0:
-        z_values = np.arange(n_hypercube, dtype=np.intp)
-        order: npt.NDArray[np.intp] = decode_morton_vectorized(z_values, chunk_shape)
-    else:
-        order = np.empty((0, n_dims), dtype=np.intp)
-
-    # For remaining elements outside the hypercube, bounds checking is needed
-    remaining: list[tuple[int, ...]] = []
-    i = n_hypercube
-    while len(order) + len(remaining) < n_total:
-        m = decode_morton(i, chunk_shape)
-        if all(x < y for x, y in zip(m, chunk_shape, strict=False)):
-            remaining.append(m)
-        i += 1
-
-    if remaining:
-        order = np.vstack([order, np.array(remaining, dtype=np.intp)])
     order.flags.writeable = False
     return order