Dr. Immanuel Gadaczek

Full-time Consultant specialized in IT in the Life Science field

Working as a Post Doc in the group of Prof. Bredow • Code Development, MSINDO using Fortran, aiccm using python and C++. • Supervising undergraduated students, • Researching on ruby: Theoretical treatment of excited states, pressure dependency of the R1 flourescence line. • Researching on organic solar cell materials, Spectra calculation and interpretation with ab initio calculations and MD simulations.

• Theory Development, Designing the new semiempirical methods MSINDO-sCIS/UCIS for the calculation of excited states in large molecules including excited state properties and the analytical gradient of the excited state, Implementation to the MSINDO code using Fortran. • Excited states in periodic systems, Using the CCM • Photocatalytic surface chemistry • Software development with Python 2.7 of msinspecsim • Spectra simulation • Graduated with Summa cum Laude

Title of PhD thesis: "Die MSINDO-sCIS- und MSINDO-UCIS-Methoden:Verfahren zur Berechnung von Eigenschaften angeregter Zustände in Molekülen und periodischen Systemen mit einem semiempirischen Ansatz" Quantum Chemistry in large molecules and solids, theoretical spectroscopy

Theoretical Chemistry, studied physics for 4 semesters in between