62bce163cd
better status propagation
2024-01-09 13:52:57 +01:00
845d3eed33
harmonize status reporting
2024-01-09 13:52:39 +01:00
70e720c032
better to understand and more flexible
2024-01-09 07:26:28 +01:00
5343aecd6f
non-binary status allows to transfer more information
2024-01-08 23:34:56 +01:00
37c0b59afd
clearer name for (non-general) postfix
2023-07-18 01:36:52 +02:00
0324e7ece1
parameters should be spelled in capitals
2023-06-04 13:52:31 +02:00
eb74d5a097
polishing
2023-01-08 11:54:42 +01:00
b8c3d75700
[skip sc] enforce interfaces (quick fix: declare as external)
2022-06-21 22:59:01 +02:00
0807112a71
new tests with T_ref = 293.15K (20°C)
...
seems to be the most common choice for room temperature
2022-02-03 22:36:27 +01:00
4a84c42112
improving constants
...
IUPAC does not specify an official ambient temperature, T=273.15K from
standard temperature and pressure (STP) is not particularly suited for our
purposes
2022-01-29 13:49:41 +01:00
dd6e9a016e
just off by 46 orders of magnitude ;)
2022-01-08 12:07:29 +00:00
510a26ded9
is used in dislotwin according to original paper
2022-01-03 10:36:23 +01:00
fb8c515a98
capitalize constants
...
not sure whether we should make exceptions for k_B and T_room
2021-11-25 11:52:52 +01:00
e941867290
single source of truth
2021-11-25 06:23:26 +01:00
Martin Diehl