Artëm E. Masunov

Prediction of Exchange Coupling Constant for Mn12 Molecular Magnet Using Dft+U

Shruba Gangopadhyay, Artëm E. Masunov, Eliza Poalelungi, 2009, ICCS.

Time-Dependent Density Functional Theory Study of Structure-Property Relationships in Diarylethene Photochromic Compounds

Artëm E. Masunov, Pansy D. Patel, P. D. Patel, 2009, ICCS.

Towards Multiscale Simulations of Carbon Nanotube Growth Process: A Density Functional Theory Study of Transition Metal Hydrides

Satyender Goel, Artëm E. Masunov, A. Masunov, 2009, ICCS.

ACD/I-Lab 4.5: An Internet Service Review

Artëm E. Masunov, 2001, J. Chem. Inf. Comput. Sci..

Theoretical Photochemistry of the Photochromic Molecules Based on Density Functional Theory Methods

Artëm E. Masunov, Ivan A. Mikhailov, A. Masunov, 2009, ICCS.

Distance and exposure dependent effective dielectric function

Themis Lazaridis, Artëm E. Masunov, Buddhadeb Mallik, 2002, J. Comput. Chem..

Predictions of Two Photon Absorption Profiles Using Time-Dependent Density Functional Theory Combined with SOS and CEO Formalisms

Artëm E. Masunov, Kevin D. Belfield, Ivan A. Mikhailov, 2009, ICCS.

Pairwise Spin-Contamination Correction Method and DFT Study of MnH and H2 Dissociation Curves

Satyender Goel, Artëm E. Masunov, A. Masunov, 2009, ICCS.