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Jülich DATA (Forschungszentrum Jülich GmbH)
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Adobe PDF - 92.0 KB - SHA-256: 5e318fce9534f69e07f57a304baa13c711d2346580baae55d7df2df7078ce043
ReducedWaspData.zip
Unknown - 980.6 KB - SHA-256: 6b11fca946eb0b9395169b2cdf0ab05d4e0832731d2e27f30cb66a77bebcd91f
XRD_files.zip
Unknown - 451.4 KB - SHA-256: 53aa42a6ed18f9f07f6d1823e099d08b4d2a3206e29c3322f331b072f88a0a33
XRD_files.zip
Plain Text - 7.6 MB - SHA-256: a6bda2bde87d635b15fa15924c4e7ab5bdcdde0de0bc7ff745bb59b41605ce88
Quantum chemical data for SCI and their transition states for reaction with H2O
Plain Text - 8.3 MB - SHA-256: ab14368e344bd2a72e170c7d0e09f58a01d0381c610d653f45cc16b81815ca0b
Quantum chemical data for SCI and their transition states for unimolecular reaction
Unknown - 2.8 KB - SHA-256: 9b44ad5bc176a2e49ef93ae818f8548e65c5a2d7d300022093930cb65af10ae4
Code
C++ header for polynomial coefficients of CHO radial functions
C++ Source - 16.1 KB - SHA-256: 34b16ff1f8ba6226ba29c6a3d51bf7ebff1e68b5be84ac48d334e3d890d9fbca
Code
generator code (C++11)
Fixed Field Text Data - 59.2 KB - SHA-256: 5089af84a601028b4233b74b86ae62bd8f73250fb7b24f539cefa6a7a7173129
Data
integer coefficients for non-zero matrix elements up to \nu = 23
Unknown - 7.3 KB - SHA-256: c65f650a30418831d6bc5a18aecb90f2a913f9543783fd397be9caf2aa1c3f8d
Code
C++ header for reading cho_unitary.dat
Adobe PDF - 157.9 KB - SHA-256: c25c4b729b19b4c49e6f1b1b5c7f273f78db453ae3864b2a06a3b4e093900cdc
Documentation
theory document
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