From 510a26ded90dfebee28c9b5a05fb362e13471013 Mon Sep 17 00:00:00 2001 From: Martin Diehl Date: Mon, 3 Jan 2022 10:36:23 +0100 Subject: [PATCH] is used in dislotwin according to original paper --- src/constants.f90 | 5 +++-- 1 file changed, 3 insertions(+), 2 deletions(-) diff --git a/src/constants.f90 b/src/constants.f90 index dd26ce78c..43bb60953 100644 --- a/src/constants.f90 +++ b/src/constants.f90 @@ -9,7 +9,8 @@ module constants public real(pReal), parameter :: & - T_ROOM = 300.0_pReal, & !< Room temperature in K - K_B = 1.38e-23_pReal !< Boltzmann constant in J/Kelvin + T_ROOM = 300.0_pReal, & !< Room temperature in K. ToDo: IUPAC: 298.15 + K_B = 1.38e-23_pReal, & !< Boltzmann constant in J/Kelvin + N_A = 6.02214076e-23_pReal !< Avogadro constant in 1/mol end module constants