Mercurial > repos > marcel > caddsuite_linux_x86_64
view CADDSuite/data/QSAR/atomic_electron_affinities.data @ 0:bac3c274238f
Migrated tool version 0.93 from old tool shed archive to new tool shed repository
author | marcel |
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date | Tue, 07 Jun 2011 16:43:30 -0400 |
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# 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