Software

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Quantum chemistry program packages:

• VASP
• CRYSTAL
• FPLO
• MOLPRO
• TURBOMOLE
• ORCA

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SPM:

• WSxM program
• SPIP

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Ploting:

• IgorPro
• Origin
• Gnuplot (+ this link)

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Crystalline and molecular structure visualisation:

• VESTA
• CrystalMaker
• XCrysDen
• MOLDEN

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Reference library:

• Papers