Code style standardization

cyllab · Feb 2, 2023 · d775d99 · d775d99
1 parent 25ecdc4
commit d775d99
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Showing 6 changed files with 0 additions and 9 deletions.
diff --git a/ccinput/calculation.py b/ccinput/calculation.py
@@ -177,7 +177,6 @@ def __init__(
         trust_me=False,
         **kwargs,
     ):
-
         self.solvent = get_abs_solvent(solvent, trust_me=trust_me)
         if self.solvent != "":
             self.solvation_model = solvation_model.lower()

diff --git a/ccinput/drivers/pysis.py b/ccinput/drivers/pysis.py
@@ -12,7 +12,6 @@
 
 
 class PysisDriver:
-
     SUPPORTED_PACKAGES = ["xtb"]
 
     SUPPORTED_KEYWORDS = {
@@ -93,7 +92,6 @@ def add_section(self, section):
             logger.warning(f"Duplicate specifications for section {section} were given")
 
     def handle_specifications(self):
-
         s = self.clean(self.calc.parameters.specifications.lower())
 
         # Duplicate code from ccinput/packages/Gaussian.py
@@ -132,7 +130,6 @@ def handle_specifications(self):
                 )
 
     def handle_main_parameters(self):
-
         if self.calc.parameters.software not in self.SUPPORTED_PACKAGES:
             raise InvalidParameter(
                 f"{self.calc.parameters} is not currently supported with the pysis driver"

diff --git a/ccinput/packages/gaussian.py b/ccinput/packages/gaussian.py
@@ -16,7 +16,6 @@
 
 
 class GaussianCalculation:
-
     TEMPLATE = """%chk={}.chk
     %nproc={}
     %mem={}MB
@@ -102,7 +101,6 @@ def add_commands(self, commands):
                 self.commands[cmd] = []
 
     def handle_specifications(self):
-
         s = self.clean(self.calc.parameters.specifications.lower())
 
         # Could be more sophisticated to catch other incorrect specifications

diff --git a/ccinput/packages/orca.py b/ccinput/packages/orca.py
@@ -22,7 +22,6 @@
 
 
 class OrcaCalculation:
-
     calc = None
 
     has_scan = False

diff --git a/ccinput/packages/xtb.py b/ccinput/packages/xtb.py
@@ -6,7 +6,6 @@
 
 
 class XtbCalculation:
-
     EXECUTABLES = {
         CalcType.OPT: "xtb",
         CalcType.CONSTR_OPT: "xtb",

diff --git a/ccinput/wrapper.py b/ccinput/wrapper.py
@@ -83,7 +83,6 @@ def generate_calculation(
     trust_me=False,
     **kwargs,
 ):
-
     if software is None:
         raise InvalidParameter("Specify a software package to use")