From 672216a6e433b45a2c625ecba7334e53082a35d7 Mon Sep 17 00:00:00 2001 From: Atilim Gunes Baydin Date: Wed, 25 Feb 2026 20:19:01 +0000 Subject: [PATCH] fix typos --- pyxtal/crystal.py | 2 +- pyxtal/molecular_crystal.py | 2 +- pyxtal/representation.py | 6 +++--- 3 files changed, 5 insertions(+), 5 deletions(-) diff --git a/pyxtal/crystal.py b/pyxtal/crystal.py index 18a149b7..bc196c1e 100644 --- a/pyxtal/crystal.py +++ b/pyxtal/crystal.py @@ -119,7 +119,7 @@ def __init__( compat, self.has_freedom = self.group.check_compatible(self.numIons) if not compat: self.valid = False - msg = "Compoisition " + str(self.numIons) + msg = "Composition " + str(self.numIons) msg += " not compatible with symmetry " msg += str(self.group.number) raise Comp_CompatibilityError(msg) diff --git a/pyxtal/molecular_crystal.py b/pyxtal/molecular_crystal.py index f9174f48..372aa13f 100644 --- a/pyxtal/molecular_crystal.py +++ b/pyxtal/molecular_crystal.py @@ -125,7 +125,7 @@ def __init__( compat, self.has_freedom = self.group.check_compatible(self.numMols) #self.valid_orientations) if not compat: - msg = f"Inincompatible compoisition {self.numMols} with symmetry {self.group.number}" + msg = f"Incompatible composition {self.numMols} with symmetry {self.group.number}" raise Comp_CompatibilityError(msg) self.set_volume() diff --git a/pyxtal/representation.py b/pyxtal/representation.py index ddd411c7..5c20cd07 100644 --- a/pyxtal/representation.py +++ b/pyxtal/representation.py @@ -48,7 +48,7 @@ def to_pyxtal(self): Args: smiles: list of smiles - compoisition: list of composition + composition: list of composition """ from pyxtal import pyxtal @@ -113,7 +113,7 @@ def to_pyxtal(self): def to_array(self): """ - Export only varibles to a 1d numpy array + Export only variables to a 1d numpy array """ cells, xyzs = self.x[0][1:], self.x[1:] x = cells @@ -278,7 +278,7 @@ def to_pyxtal(self, smiles=None, composition=None): Args: smiles: list of smiles - compoisition: list of composition + composition: list of composition """ from pyxtal import pyxtal