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36 Publications
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Debasish Koner
Assistant Professor
Department of Chemistry
debasishkoner@chy.iith.ac.in (Work)
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Publications - 36
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Publications (36)
Publications (36)
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Articles
Spontaneous Generation of Aryl Carbocations from Phenols in Aqueous Microdroplets: Aromatic SN1 Reactions at the Air-Water Interface
A. Nandy
,
A. Kumar
,
...
,
Debasish Koner
and
S. Banerjee
(5 authors)
2023 | American Chemical Society
Articles
Molecular-level understanding of the rovibrational spectra of N2O in gaseous, supercritical and liquid SF6and Xe
Kai Töpfer
,
Debasish Koner
,
...
,
Markus Meuwly
(5 authors)
2023 | American Institute of Physics Inc.
Articles
Low-temperature kinetics for the N + NO reaction: experiment guides the way
K.M. Hickson
,
J.C. San Vicente Veliz
,
Debasish Koner
and
M. Meuwly
2023 | Royal Society of Chemistry
Articles
Rapid Molecular Evaluation of Human Kidney Tissue Sections by In Situ Mass Spectrometry and Machine Learning to Classify the Nephrotic Syndrome
S. Mondal
,
M.P. Singh
,
...
,
Debasish Koner
,
...
,
S. Banerjee
(10 authors)
2023 | American Chemical Society
Articles
High-resolution electronic and vibrational spectroscopy of small-to-medium sized molecules with ab initio potential energy surface
S. Ray
,
Debasish Koner
and
P. Mondal
2023 | Institute of Physics
Articles
Mass Spectrometry Imaging of Lumpectomy Specimens Deciphers Diacylglycerols as Potent Biomarkers for the Diagnosis of Breast Cancer
S. Mondal
,
Y. Sthanikam
,
...
,
Debasish Koner
,
...
,
S. Banerjee
(9 authors)
2023 | American Chemical Society
Articles
Machine learning product state distributions from initial reactant states for a reactive atom-diatom collision system
J. Arnold
,
J.C. San Vicente Veliz
,
Debasish Koner
,
...
,
M. Meuwly
(6 authors)
2022 | American Institute of Physics Inc.
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PDF
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Articles
Photodissociation dynamics of N 3 +
S. Patra
,
J.C. San Vicente Veliz
,
Debasish Koner
,
...
,
M. Meuwly
(5 authors)
2022 | American Institute of Physics Inc.
Articles
Quantum and quasiclassical dynamical simulations for the Ar2H+on a new global analytical potential energy surface
Debasish Koner
2021 | American Institute of Physics Inc.
Reviews
Atom–diatom reactive scattering collisions in protonated rare gas systems
Debasish Koner
,
L. Barrios
,
...
,
A.N. Panda
(4 authors)
2021 | MDPI AG
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PDF
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Articles
The C(3P) + O2(3Σg-) → CO2↔ CO(1Σ+) + O(1D)/O(3P) reaction: thermal and vibrational relaxation rates from 15 K to 20 000 K
J.C. San Vicente Veliz
,
Debasish Koner
,
...
,
M. Meuwly
(5 authors)
2021 | Royal Society of Chemistry
Articles
Quantum and Classical Dynamics of the N(2D) + N2Reaction on Its Ground Doublet State N3(12A″) Potential Energy Surface
S. Korutla
,
Debasish Koner
,
...
,
R.R. Tammineni
(4 authors)
2021 | American Chemical Society
Articles
Machine Learning for Observables: Reactant to Product State Distributions for Atom-Diatom Collisions
J. Arnold
,
Debasish Koner
,
...
,
M. Meuwly
(6 authors)
2020 | American Chemical Society
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PDF
Preprint
Articles
Formation and Stabilization of Ground and Excited-State Singlet O2 upon Recombination of 3P Oxygen on Amorphous Solid Water
M. Pezzella
,
Debasish Koner
and
M. Meuwly
2020 | American Chemical Society
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PDF
Preprint
Articles
Accurate reproducing kernel-based potential energy surfaces for the triplet ground states of N2O and dynamics for the N + NO ↔ O + N2and N2+ O → 2N + O reactions
Debasish Koner
,
J.C. San Vicente Veliz
,
...
,
M. Meuwly
(4 authors)
2020 | Royal Society of Chemistry
Articles
Machine Learning Models of Vibrating H2CO: Comparing Reproducing Kernels, FCHL, and PhysNet
S. Käser
,
Debasish Koner
,
...
,
M. Meuwly
(5 authors)
2020 | American Chemical Society
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PDF
Preprint
Articles
Permutationally Invariant, Reproducing Kernel-Based Potential Energy Surfaces for Polyatomic Molecules: From Formaldehyde to Acetone
Debasish Koner
and
M. Meuwly
2020 | American Chemical Society
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PDF
Preprint
Articles
N3+: Full-dimensional ground state potential energy surface, vibrational energy levels, and dynamics
Debasish Koner
,
M. Schwilk
,
...
,
M. Meuwly
(5 authors)
2020 | American Institute of Physics Inc.
Download
PDF
Publisher Copy
Articles
The N(4S) + O2(X3Σ - G) ↔ O(3P) + NO(X2Π) reaction: Thermal and vibrational relaxation rates for the 2A′, 4A′ and 2A′′ states
J.C. San Vicente Veliz
,
Debasish Koner
,
...
,
M. Meuwly
(5 authors)
2020 | Royal Society of Chemistry
Reviews
High-dimensional potential energy surfaces for molecular simulations: From empiricism to machine learning
O.T. Unke
,
Debasish Koner
,
...
,
M. Meuwly
(5 authors)
2020 | IOP Publishing Ltd
Showing 1-20 of 36 results
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