added missing unit conversiation

FNTwin · FNTwin · commit 20f873d2cd9d · 2023-10-31T13:33:44.000-04:00
diff --git a/src/openqdc/utils/units.py b/src/openqdc/utils/units.py
@@ -72,3 +72,4 @@ def get_conversion(in_unit: str, out_unit: str):
 )
 Conversion("hartree/ang", "kcal/mol/ang", lambda x: get_conversion("hartree", "kcal/mol")(x))
 Conversion("hartree/ang", "hartree/bohr", lambda x: get_conversion("bohr", "ang")(x))
+Conversion("hartree/bohr", "hartree/ang", lambda x: get_conversion("ang", "bohr")(x))

Original file line number	Diff line number	Diff line change
`@@ -72,3 +72,4 @@ def get_conversion(in_unit: str, out_unit: str):`
`72`	`72`	`)`
`73`	`73`	`Conversion("hartree/ang", "kcal/mol/ang", lambda x: get_conversion("hartree", "kcal/mol")(x))`
`74`	`74`	`Conversion("hartree/ang", "hartree/bohr", lambda x: get_conversion("bohr", "ang")(x))`
	`75`	`+Conversion("hartree/bohr", "hartree/ang", lambda x: get_conversion("ang", "bohr")(x))`