sparse-ir 1.1.0__py3-none-any.whl → 1.1.1__py3-none-any.whl

sparse_ir/__init__.py

@@ -12,7 +12,7 @@ intermediate representation of correlation functions.  It provides:
 """
 __copyright__ = "2020-2024 Markus Wallerberger, Hiroshi Shinaoka, and others"
 __license__ = "MIT"
-__version__ = "1.1.0"
+__version__ = "1.1.1"
 
 from .kernel import RegularizedBoseKernel, LogisticKernel
 from .sve import compute as compute_sve, SVEResult

sparse_ir/abstract.py

@@ -150,14 +150,26 @@ class AbstractBasis:
         """Real frequency cutoff or `None` if not present"""
         raise NotImplementedError()
 
-    def default_tau_sampling_points(self):
-        """Default sampling points on the imaginary time axis"""
+    def default_tau_sampling_points(self, *, npoints=None):
+        """Default sampling points on the imaginary time axis
+
+        Arguments:
+            npoints (int):
+                Minimum number of sampling points to return.
+
+                .. versionadded: 1.1
+        """
         raise NotImplementedError()
 
-    def default_matsubara_sampling_points(self, *, positive_only=False):
+    def default_matsubara_sampling_points(self, *, npoints=None,
+                                          positive_only=False):
         """Default sampling points on the imaginary frequency axis
 
         Arguments:
+            npoints (int):
+                Minimum number of sampling points to return.
+
+                .. versionadded: 1.1
             positive_only (bool):
                 Only return non-negative frequencies.  This is useful if the
                 object to be fitted is symmetric in Matsubura frequency,

sparse_ir/augment.py

@@ -106,13 +106,21 @@ class AugmentedBasis(abstract.AbstractBasis):
     def wmax(self):
         return self._basis.wmax
 
-    def default_tau_sampling_points(self):
-        x = basis._default_sampling_points(self._basis.sve_result.u, self.size)
-        return self.beta/2 * (x + 1)
-
-    def default_matsubara_sampling_points(self, *, positive_only=False):
-        return basis._default_matsubara_sampling_points(
-                    self._basis._uhat_full, self.size, positive_only=positive_only)
+    def default_tau_sampling_points(self, *, npoints=None):
+        if npoints is None:
+            npoints = self.size
+
+        # Return the sampling points of the underlying basis, but since we
+        # use the size of self, we add two further points.  One then has to
+        # hope that these give good sampling points.
+        return self._basis.default_tau_sampling_points(npoints=npoints)
+
+    def default_matsubara_sampling_points(self, *, npoints=None,
+                                          positive_only=False):
+        if npoints is None:
+            npoints = self.size
+        return self._basis.default_matsubara_sampling_points(
+                                npoints=npoints, positive_only=positive_only)
 
     @property
     def is_well_conditioned(self):

sparse_ir/basis.py

@@ -169,16 +169,31 @@ class FiniteTempBasis(abstract.AbstractBasis):
     def sve_result(self):
         return self._sve_result
 
-    def default_tau_sampling_points(self):
-        x = _default_sampling_points(self._sve_result.u, self.size)
+    def default_tau_sampling_points(self, *, npoints=None):
+        if npoints is None:
+            npoints = self.size
+        x = _default_sampling_points(self._sve_result.u, npoints)
         return self._beta/2 * (x + 1)
 
-    def default_matsubara_sampling_points(self, *, positive_only=False):
-        return _default_matsubara_sampling_points(self._uhat_full, self.size,
+    def default_matsubara_sampling_points(self, *, npoints=None,
+                                          positive_only=False):
+        if npoints is None:
+            npoints = self.size
+        return _default_matsubara_sampling_points(self._uhat_full, npoints,
                                                   positive_only=positive_only)
 
-    def default_omega_sampling_points(self):
-        y = _default_sampling_points(self._sve_result.v, self.size)
+    def default_omega_sampling_points(self, *, npoints=None):
+        """Return default sampling points in imaginary time.
+
+        Arguments:
+            npoints (int):
+                Minimum number of sampling points to return.
+
+                .. versionadded: 1.1
+        """
+        if npoints is None:
+            npoints = self.size
+        y = _default_sampling_points(self._sve_result.v, npoints)
         return self._wmax * y
 
     def rescale(self, new_beta):

sparse_ir/poly.py

@@ -208,7 +208,7 @@ class PiecewiseLegendreFT:
     ``n`` must be odd.
     """
     _DEFAULT_GRID = np.hstack([np.arange(2**6),
-                        (2**np.linspace(6, 25, 16*(25-6)+1)).astype(int)])
+                        (2**np.linspace(6, 35, 16*(35-6)+1)).astype(int)])
 
     def __init__(self, poly, freq='even', n_asymp=None, power_model=None):
         if poly.xmin != -1 or poly.xmax != 1:

sparse_ir/sampling.py

@@ -35,6 +35,8 @@ class AbstractSampling:
                 to the sampling points for which the sampling objects was
                 created.
 
+                .. versionadded:: 1.1
+
         Return:
             Array where the `n`-th item along `axis` corresponds to the
             value on the `n`-th sampling point (or value on `point[n]`, if
@@ -66,6 +68,8 @@ class AbstractSampling:
                 Points on which the `ax` is given.  Defaults to the sampling
                 points for which the sampling objects was created.
 
+                .. versionadded:: 1.1
+
         Return:
             Array where the `l`-th item along `axis` corresponds to the
             `l`-th basis coefficient

{sparse_ir-1.1.0.dist-info → sparse_ir-1.1.1.dist-info}/METADATA

@@ -1,6 +1,6 @@
 Metadata-Version: 2.1
 Name: sparse-ir
-Version: 1.1.0
+Version: 1.1.1
 Summary: intermediate representation (IR) basis for electronic propagator
 Home-page: https://github.com/SpM-lab/sparse-ir
 Author: ['Markus Wallerberger', 'Hiroshi Shinaoka', 'Kazuyoshi Yoshimi', 'Junya Otsuki', 'Chikano Naoya']

sparse_ir-1.1.1.dist-info/RECORD

@@ -0,0 +1,20 @@
+sparse_ir/__init__.py,sha256=dDgJtNgKRy0D9q6rONu50lowMCnrdmvB4L9e-8eG5pc,816
+sparse_ir/_gauss.py,sha256=9Ou38SfucUjY83o8Tz62s-gXfWDC8QEHBjiUzcbWaY4,9621
+sparse_ir/_roots.py,sha256=ARpyYhhI5gR1AT1zDgezVgCxnHEaJwGF38jEv6ebarA,4351
+sparse_ir/_util.py,sha256=93s7tGcXxz3mwHsBQmAh-6EQ26xLbUeFHVtlnzQxRps,3004
+sparse_ir/abstract.py,sha256=I7RMcHwgPrtn_XBZ4x_XPxaqp32OLFtXQ5bC2mKp7ic,6604
+sparse_ir/adapter.py,sha256=ptiHkTBwZ8aNbtFMnr9k2Rt_v5zwrDyPJ1yx-kiDvew,8351
+sparse_ir/augment.py,sha256=vRPMS0Roa2zqCqZVyFFo-g4lfr2ZGOIhfGGbt42Kj98,9976
+sparse_ir/basis.py,sha256=3mW2XKuLxzHomPCbm3MgxvJhrP3HdP-QkGOgI8W7E2o,13316
+sparse_ir/basis_set.py,sha256=zLD51j9X3iuXfX2nzmn5yRRn7S_GOOyCRFqb05OMDXI,2869
+sparse_ir/dlr.py,sha256=X6orDjvsOAsFrZsCh8vfedu0_SmTvIpSQmGabfI9pi8,5361
+sparse_ir/kernel.py,sha256=2HO77HTOK2WJKizDgr1nmmyhd1mGYT2WvKrFwLiMhjM,18487
+sparse_ir/poly.py,sha256=moPMTxJvd2_g43vcyjHSsyBjcQ1lnuPyIjfce6j_AgI,18359
+sparse_ir/sampling.py,sha256=BoHOHcLAvQjYR8KwK8Ee0LgZz3q3OgMBuLPgG494VEM,13879
+sparse_ir/svd.py,sha256=iQwpBCFSPJeKqhAIlufzz9Ybpm1dq382Km3TU-UvNuc,3375
+sparse_ir/sve.py,sha256=pVUKg_cLphx-lRCfrDJXrpkow97vjIgvvSrxA7lhzzg,15179
+sparse_ir-1.1.1.dist-info/LICENSE.txt,sha256=3tGlA0QNYsfjETaQqJO0Ixne5PQ16PNVJiDcGsgHER0,1079
+sparse_ir-1.1.1.dist-info/METADATA,sha256=85T_HOwLPWOF-ScnCIdhyfZBqRV14Iy7SJEc1G9UcBQ,6458
+sparse_ir-1.1.1.dist-info/WHEEL,sha256=G16H4A3IeoQmnOrYV4ueZGKSjhipXx8zc8nu9FGlvMA,92
+sparse_ir-1.1.1.dist-info/top_level.txt,sha256=UsscWAzJg7fKo9qmIwW8jnG7CAfhFzWYBOTXVySzuA0,10
+sparse_ir-1.1.1.dist-info/RECORD,,

sparse_ir-1.1.0.dist-info/RECORD

@@ -1,20 +0,0 @@
-sparse_ir/__init__.py,sha256=BzVg_maIuofnQArELnsb3Gdi4LnHa7OPt7prTjdbnnM,816
-sparse_ir/_gauss.py,sha256=9Ou38SfucUjY83o8Tz62s-gXfWDC8QEHBjiUzcbWaY4,9621
-sparse_ir/_roots.py,sha256=ARpyYhhI5gR1AT1zDgezVgCxnHEaJwGF38jEv6ebarA,4351
-sparse_ir/_util.py,sha256=93s7tGcXxz3mwHsBQmAh-6EQ26xLbUeFHVtlnzQxRps,3004
-sparse_ir/abstract.py,sha256=bifLMUuDQzWjZZtB2s7-yBTZ9dhbkkox2lWh1fbzaas,6250
-sparse_ir/adapter.py,sha256=ptiHkTBwZ8aNbtFMnr9k2Rt_v5zwrDyPJ1yx-kiDvew,8351
-sparse_ir/augment.py,sha256=1Gn57-_13968fsgC-I5oE_nGiP4bWvjEbGGsNdM6jvM,9624
-sparse_ir/basis.py,sha256=2PSRgJQyPA_d3cUJhNGvklc6cQLe__yMLzDsuj2JgwQ,12833
-sparse_ir/basis_set.py,sha256=zLD51j9X3iuXfX2nzmn5yRRn7S_GOOyCRFqb05OMDXI,2869
-sparse_ir/dlr.py,sha256=X6orDjvsOAsFrZsCh8vfedu0_SmTvIpSQmGabfI9pi8,5361
-sparse_ir/kernel.py,sha256=2HO77HTOK2WJKizDgr1nmmyhd1mGYT2WvKrFwLiMhjM,18487
-sparse_ir/poly.py,sha256=XbNjgFaofE9zSvPPPYmsDVLLea2k8CSEopfxx-e48ko,18359
-sparse_ir/sampling.py,sha256=AR6ONMwKjQXVvmulwCNk93J-1OmNS8fYutXCLdfReCA,13801
-sparse_ir/svd.py,sha256=iQwpBCFSPJeKqhAIlufzz9Ybpm1dq382Km3TU-UvNuc,3375
-sparse_ir/sve.py,sha256=pVUKg_cLphx-lRCfrDJXrpkow97vjIgvvSrxA7lhzzg,15179
-sparse_ir-1.1.0.dist-info/LICENSE.txt,sha256=3tGlA0QNYsfjETaQqJO0Ixne5PQ16PNVJiDcGsgHER0,1079
-sparse_ir-1.1.0.dist-info/METADATA,sha256=MIFpjO8gtK_A2NzU6g4SNYhZ-OKdUaNZqTpSD3V_VIU,6458
-sparse_ir-1.1.0.dist-info/WHEEL,sha256=G16H4A3IeoQmnOrYV4ueZGKSjhipXx8zc8nu9FGlvMA,92
-sparse_ir-1.1.0.dist-info/top_level.txt,sha256=UsscWAzJg7fKo9qmIwW8jnG7CAfhFzWYBOTXVySzuA0,10
-sparse_ir-1.1.0.dist-info/RECORD,,