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Compressed Archive - 1.7 GB - MD5: 3e9cb9271b36509b7d2c56f103d0551d
Game EXE file. Unzip the file to run the game exe file.
ZIP Archive - 1.7 GB - MD5: 541c237565ec1a37d5552216afb3811f
The `PET_calculations` folder contains Gaussian output files used to evaluate photoinduced electron transfer (PET) behavior in dye-Trp systems. The calculations are organized by solvent/environment, compound, and electronic state, including ground-state, locally excited-state, an...
ZIP Archive - 634.2 MB - MD5: ffb2fe4dd8600316c8f297f15d1a11ad
The `TICT_calculations` folder contains Gaussian calculation files used to examine twisted intramolecular charge-transfer (TICT) behavior for compounds 10 and 14. The deposited data include ground-state and excited-state optimized structures, TICT/dihedral rotation scans, refined...
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ZIP Archive - 65.7 MB - MD5: 932e4c1847a6ff2b5cbf9c020f013534
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ZIP Archive - 643.0 MB - MD5: 677d1db92cf56327b0c2a20aa787b262
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ZIP Archive - 170.0 MB - MD5: ea626fb3c52f5417aaa57c5d61060569
Compressed Archive - 31.9 MB - MD5: 84379525f03b3c005486c01badf5139a
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