Changed 'bohr_per_atu_si' to 'bohr_per_atu_electron_si' (52364979) · Commits · 郑智淋 / lammps

src/KIM/kim_units.cpp

+2 −2

Original line number	Diff line number	Diff line
		@@ -175,7 +175,7 @@ double const nanometer_per_nanosecond_si =
		nanometer_si/nanosecond_si; // [m/s] nanometer/nanosecond
		double const centimeter_per_second_si =
		centimeter_si; // [m/s] centimeter/second
		double const bohr_per_atu_si =
		double const bohr_per_atu_electron_si =
		bohr_si/atu_electron_si; // [m/s] bohr/atu

		/*----------------------
		@@ -803,7 +803,7 @@ double get_velocity_conversion_factor(units from_unit_enum, units to_unit_enum)
		conv[meter_per_second][angstrom_per_femtosecond] = 1.0/angstrom_per_femtosecond_si;
		conv[meter_per_second][angstrom_per_picosecond] = 1.0/angstrom_per_picosecond_si;
		conv[meter_per_second][centimeter_per_second] = 1.0/centimeter_per_second_si;
		conv[meter_per_second][bohr_per_atu] = 1.0/bohr_per_atu_si;
		conv[meter_per_second][bohr_per_atu] = 1.0/bohr_per_atu_electron_si;
		conv[meter_per_second][micrometer_per_microsecond] = 1.0/micrometer_per_microsecond_si;
		conv[meter_per_second][nanometer_per_nanosecond] = 1.0/nanometer_per_nanosecond_si;