화학공학소재연구정보센터
검색결과 : 33건
No. Article
1 Manipulation of Diatomic Molecules with Oriented External Electric Fields: Linear Correlations in Atomic Properties Lead to Nonlinear Molecular Responses
Sowlati-Hashjin S, Karttunen M, Matta CF
Journal of Physical Chemistry A, 124(23), 4720, 2020
2 On the Unusual Synclinal Conformations of Hexafluorobutadiene and Structurally Similar Molecules
Braden DA, Matta CF
Journal of Physical Chemistry A, 122(18), 4538, 2018
3 Effects of Intense Electric Fields on the Double Proton Transfer in the Watson-Crick Guanine-Cytosine Base Pair
Arabi AA, Matta CF
Journal of Physical Chemistry B, 122(37), 8631, 2018
4 Notes on The Energy Equivalence of Information
Matta CF, Massa L
Journal of Physical Chemistry A, 121(47), 9131, 2017
5 A QTAIM topological analysis of the P3HT-PCBM dimer
Rodriguez JI, Matta CF, Uribe EA, Gotz AW, Castillo-Alvarado FL, Molina-Brito B
Chemical Physics Letters, 644, 157, 2016
6 Difluorodiazirine (CF2N2): A comparative quantum mechanical study of the first triplet and first singlet excited states
Terrabuio LA, Haiduke RLA, Matta CF
Chemical Physics Letters, 655, 96, 2016
7 Nonnuclear Attractors in Heteronuclear Diatomic Systems
Terrabuio LA, Teodoro TQ, Matta CF, Haiduke RLA
Journal of Physical Chemistry A, 120(8), 1168, 2016
8 Electron localization-delocalization matrices in the prediction of pK(a)'s and UV-wavelengths of maximum absorbance of p-benzoic acids and the definition of super-atoms in molecules
Sumar I, Ayers PW, Matta CF
Chemical Physics Letters, 612, 190, 2014
9 The Localization-Delocalization Matrix and the Electron-Density-Weighted Connectivity Matrix of a Finite Graphene Nanoribbon Reconstructed from Kernel Fragments
Timm MJ, Matta CF, Massa L, Huang LL
Journal of Physical Chemistry A, 118(47), 11304, 2014
10 Can a Formally Zwitterionic Rhodium(I) Complex Emulate the Charge Density of a Cationic Rhodium(I) Complex? A Combined Synchrotron X-ray and Theoretical Charge-Density Study
Bendeif EE, Matta CF, Stradiotto M, Fertey P, Lecomte C
Inorganic Chemistry, 51(6), 3754, 2012