Ekadashi Pradhan

发表

Charge transfer dynamics at the boron subphthalocyanine chloride/C60 interface: non-adiabatic dynamics study with Libra-X.

R. Asahi, A. Akimov, Kosuke Sato, 2018, Physical chemistry chemical physics : PCCP.

Non-adiabatic molecular dynamics with ΔSCF excited states

A. Akimov, Kosuke Sato, Ekadashi Pradhan, 2018, Journal of physics. Condensed matter : an Institute of Physics journal.

Scaling relationships for nonadiabatic energy relaxation times in warm dense matter: toward understanding the equation of state.

A. Akimov, Ekadashi Pradhan, R. Magyar, 2016, Physical chemistry chemical physics : PCCP.

Fitting potential energy surfaces to sum-of-products form with neural networks using exponential neurons

Alex Brown, Ekadashi Pradhan, 2017 .

Vibrational energies for HFCO using a neural network sum of exponentials potential energy surface.

Alex Brown, Ekadashi Pradhan, 2016, The Journal of chemical physics.

Structure-reactivity studies on hypervalent square-pyramidal dithieno[3,2-b:2',3'-d]phospholes.

Joshua R. Gaffen, T. Baumgartner, Ekadashi Pradhan, 2021, Dalton transactions.

The synthesis, properties, and reactivity of Lewis acidic aminoboranes.

Tao Zeng, Christopher B. Caputo, Ekadashi Pradhan, 2021, Organic & biomolecular chemistry.

A ground state potential energy surface for HONO based on a neural network with exponential fitting functions.

Alex Brown, Ekadashi Pradhan, 2017, Physical chemistry chemical physics : PCCP.

Designs of Singlet Fission Chromophores with a Diazadiborinine Framework**

Christopher B. Caputo, Ekadashi Pradhan, Tao Zeng, 2020, ChemPhotoChem.

Diboron- and Diaza-Doped Anthracenes and Phenanthrenes: Their Electronic Structures for Being Singlet Fission Chromophores.

Seunghoon Lee, C. Choi, Ekadashi Pradhan, 2020, The journal of physical chemistry. A.

The lowest lying excited electronic states for HFCO including a potential energy surface for S 1 in sum-of-products form

Alex Brown, Ekadashi Pradhan, 2020, Molecular Physics.

Neural network exponential fitting of a potential energy surface with multiple minima: Application to HFCO

Alex Brown, Ekadashi Pradhan, 2016 .

Bis(pentafluorophenyl)phenothiazylborane - an intramolecular frustrated Lewis pair catalyst for stannane dehydrocoupling.

Christopher B. Caputo, Ekadashi Pradhan, Tao Zeng, 2020, Dalton transactions.

Design of the Smallest Intramolecular Singlet Fission Chromophore with the Fastest Singlet Fission.

Ekadashi Pradhan, Tao Zeng, 2022, The journal of physical chemistry letters.

Triplet Separation after the Fastest Intramolecular Singlet Fission in the Smallest Chromophore.

Ekadashi Pradhan, T. Zeng, 2023, Journal of chemical theory and computation.

Dicarbonyl anthracenes and phenanthrenes as singlet fission chromophores

Chong Ju Choi, Seunghoon Lee, Tao Zeng, 2022, Canadian journal of chemistry (Print).

BF3-Catalyzed Intramolecular Fluorocarbamoylation of Alkynes via Halide Recycling.

M. Lautens, Ekadashi Pradhan, Tao Zeng, 2023, Journal of the American Chemical Society.

Ab initio potential energy and dipole moment surfaces for CS2: determination of molecular vibrational energies.

José-Luis Carreón-Macedo, Alex Brown, Ekadashi Pradhan, 2013, The journal of physical chemistry. A.

Solvation shell dynamics of Na+ and Cl- ion pairs in selected water-DMSO mixtures

B. L. Tembe, Ekadashi Pradhan, Bhalachandra L. Tembe, 2010, ICCS.

Postsynthetic Crystalline Transformation in Two-Dimensional Perovskites via Organothiol-Based Chemistry

Zhenyu Yang, Ekadashi Pradhan, Tao Zeng, 2021 .

A ground state potential energy surface for HONO based on a neural network with exponential fitting functions.

Alex Brown, Ekadashi Pradhan, 2017, Physical chemistry chemical physics : PCCP.