Software for calculting DFT and Raman spectra for Windows

AI Thread Summary
Quantum ESPRESSO is a recommended program for performing DFT calculations on Windows, offering an integrated suite of open-source software for electronic-structure calculations and materials modeling at the nanoscale. It supports both DFT calculations and the calculation of Raman spectra, making it a suitable choice for users seeking free software options in this field.
GSRush
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Dear Friends!
Please recommend a program for performing DFT calculations on Windows. It should also be capable of calculating Raman spectra. It would be highly desirable if the program will be free.
Sincerely,
Aleksandr
 
Computer science news on Phys.org
One popular program for performing DFT calculations on Windows is Quantum ESPRESSO. Quantum ESPRESSO is an integrated suite of open-source software for electronic-structure calculations and materials modeling at the nanoscale. It is capable of performing DFT calculations and can also calculate Raman spectra.
 

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