Mercurial > repos > marcel > caddsuite_linux_x86_64
view CADDSuite/data/QSAR/atomic_electron_affinities.data @ 3:ff6df146c0d5
Uploaded
author | marcel |
---|---|
date | Sun, 26 Jun 2011 13:53:57 -0400 |
parents | bac3c274238f |
children |
line wrap: on
line source
# atomic electron affinities, taken from CRC Handbook of Chemistry and Physics, 79th edition, 1998; non-excistant values like unstable ions have 0.0 0.754593 0.0 0.6180 0.0 0.277 1.2629 0.0 1.4611103 3.401190 0.0 0.547926 0.0 0.441 1.385 0.7465 2.077104 3.61269 0.0 0.50147 0.02455 0.188 0.079 0.525 0.666 0.0 0.151 0.662 1.156 1.235 0.0 0.3 1.233 0.81 2.020670 3.363590 0.0 0.48592 0.048 0.307 0.426 0.893 0.748 0.55 1.05 1.137 0.562 1.302 0.0 0.3 1.112 1.046 1.9708 3.059038 0.0 0.471626 0.15 0.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.322 0.815 0.15 1.1 1.5638 2.128 2.30863 0.0 0.2 0.364 0.946 1.9 2.8 0.0 0.46