Reconsideration of solvent effects calculated by semiempirical quantum chemical methods. - Miroslaw Szafran; Mati Karelson; Alan R. Katritzky; Jacek Koput; Michael C. Zerner (J. Comput. Chem., 1993)

Ab initio prediction of the structure and vibration-rotation spectroscopic properties of Na2OH and K2OH. - Artur Gertych; Jacek Koput (J. Comput. Chem., 2010)

Accurate Ab initio potential energy surface and vibration-rotation energy levels of hydrogen peroxide. - Pawel Malyszek; Jacek Koput (J. Comput. Chem., 2013)

Ab initio ground-state potential energy function and vibration-rotation energy levels of imidogen, NH. - Jacek Koput (J. Comput. Chem., 2015)

Ab Initio spectroscopic characterization of borane, BH, in its X1Σ+ electronic state. - Jacek Koput (J. Comput. Chem., 2015)

Ab initio potential energy surface and vibration-rotation energy levels of silicon dicarbide, SiC2. - Jacek Koput (J. Comput. Chem., 2016)

Ab initio potential energy surface and vibration-rotation energy levels of beryllium monohydroxide. - Jacek Koput (J. Comput. Chem., 2017)

Ab initio potential energy surface and vibration-rotation energy levels of sulfur dioxide. - Jacek Koput (J. Comput. Chem., 2017)

Ab initio potential energy surface and vibration-rotation energy levels of germanium dicarbide, GeC2. - Jacek Koput (J. Comput. Chem., 2018)

Ab initio structure and vibration-rotation dynamics of germylene, GeH2. - Jacek Koput (J. Comput. Chem., 2019)

Ab Initio Ground-State Potential Energy Function and Vibration-Rotation Energy Levels of Aluminum Monohydride. - Jacek Koput (J. Comput. Chem., 2019)

Ground-state potential energy functions and vibration-rotation energy levels of beryllium lithium and its cation. - Jacek Koput (J. Comput. Chem., 2022)

Ab initio characterization of the aluminum dimer in its X 3 Π u and A 3 ∑ g - electronic states. - Jacek Koput (J. Comput. Chem., 2022)