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Photodissociation in phenol-water clusters: Implications for reactions at the...
Data supporting the calculations in the paper. These include the output and database files from the DD-vMCG simulations of the photodissociation of phenol run using the Quantics... -
Molecular Tully Model Data Sets and Quantics files
Datasets contain the input and output files for the Quantics program to run MCTDH, vMCG, DD-vMCG and TSH calculations on the Ibele-Curchod models. There are six directories, two... -
Quantum dynamics of excited state proton transfer in green fluorescent protein
Data supporting the calculations in the paper. These include the input and output files for the Quantics program to run DD-vMCG and iMCG simulations of a GFP cluster model, as... -
Prediction Through Quantum Dynamics Simulations: Photo-excited Cyclobutanone
Datasets contain the input and output files for the Quantics program to run MCTDH and DD-vMCG calculations on cyclobutanone. There are various directories containing the... -
Modelling Photodissociation: Quantum Dynamics Simulations of Methanol
Data supporting the calculations in the paper. These include the input and output and database files for the Quantics program to run DD-vMCG simulations of the photodissociation...
