검색결과 : 13건
No. | Article |
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1 |
SSAIMS-Stochastic-Selection Ab Initio Multiple Spawning for Efficient Nonadiabatic Molecular Dynamics Curchod BFE, Glover WJ, Martinez TJ Journal of Physical Chemistry A, 124(30), 6133, 2020 |
2 |
Synthesis of Organic Super-Electron-Donors by Reaction of Nitrous Oxide with N-Heterocyclic Olefins (vol 141, pg 17112, 2019) Eymann LYM, Varava P, Shved AM, Curchod BFE, Liu Y, Planes OM, Sienkiewicz A, Scopelliti R, Tirani FF, Severin K Journal of the American Chemical Society, 142(2), 1112, 2020 |
3 |
Photoelectron Spectroscopy of the Hexafluorobenzene Cluster Anions: (C6F6)(n)(-) (n=1-5) and I-(C6F6) Rogers JP, Anstoter CS, Bull JN, Curchod BFE, Verlet JRR Journal of Physical Chemistry A, 123(8), 1602, 2019 |
4 |
Excited-State Molecular Dynamics Triggered by Light Pulses-Ab Initio Multiple Spawning vs Trajectory Surface Hopping Mignolet B, Curchod BFE Journal of Physical Chemistry A, 123(16), 3582, 2019 |
5 |
Synthesis of Organic Super-Electron-Donors by Reaction of Nitrous Oxide with N-Heterocyclic Olefins Eymann LYM, Varava P, Shved AM, Curchod BFE, Liu YZ, Planes OM, Sienkiewicz A, Scopelliti R, Tirani FF, Severin K Journal of the American Chemical Society, 141(43), 17112, 2019 |
6 |
Ab Initio Nonadiabatic Quantum Molecular Dynamics Curchod BFE, Martinez TJ Chemical Reviews, 118(7), 3305, 2018 |
7 |
Synthesis and Characterization of a Series of Bis-homoleptic Cycloruthenates with Terdentate Ligands as a Family of Panchromatic Dyes Rees TW, Liao JF, Sinopoli A, Male L, Calogero G, Curchod BFE, Baranoff E Inorganic Chemistry, 56(16), 9903, 2017 |
8 |
Ab Initio Multiple Spawning Photochemical Dynamics of DMABN Using GPUs Curchod BFE, Sisto A, Martinez TJ Journal of Physical Chemistry A, 121(1), 265, 2017 |
9 |
Characterization of the Photochemical Properties of 5-Benzyluracil via Time-Dependent Density Functional Theory Micciarelli M, Curchod BFE, Bonella S, Altucci C, Valadan M, Rothlisberger U, Tavernelli I Journal of Physical Chemistry A, 121(20), 3909, 2017 |
10 |
The Charge Transfer Problem in Density Functional Theory Calculations of Aqueously Solvated Molecules Isborn CM, Mar BD, Curchod BFE, Tavernelli I, Martinez TJ Journal of Physical Chemistry B, 117(40), 12189, 2013 |