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Relaxation of the 2a1 ionized water dimer: An interplay of intermolecular Coulombic decay (ICD) and proton transfer processes

The Journal of chemical physics, 2024-06, Vol.160 (21)

2024

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Effect of charge and solvation shell on non-radiative decay processes in s-block cationic metal ion water clusters

The Journal of chemical physics, 2023-08, Vol.159 (5)

2023

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Geometry-dependent lifetime of Interatomic coulombic decay using equation-of-motion coupled cluster method

The Journal of chemical physics, 2014-12, Vol.141 (23), p.234108-234108

2014

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Electron transfer mediated decay in HeLi2 cluster: Potential energy surfaces and decay widths

The Journal of chemical physics, 2019-04, Vol.150 (16), p.164309-164309

2019

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Attosecond spectroscopy reveals alignment dependent core-hole dynamics in the ICl molecule

Nature communications, 2020-11, Vol.11 (1), p.5810-5810, Article 5810

2020

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Equation-of-motion coupled-cluster method for the study of shape resonance

The Journal of chemical physics, 2012-06, Vol.136 (23), p.234110-234110

2012

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Formaldehyde roaming dynamics: Comparison of quasi-classical trajectory calculations and experiments

The Journal of chemical physics, 2017-07, Vol.147 (1), p.013936-013936

2017

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CAP/EOM-CCSD method for the study of potential curves of resonant states

Physical chemistry chemical physics : PCCP, 2013-11, Vol.15 (41), p.17915-17921

2013

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Full Dynamical and Ab Initio Investigation of the Electron Transfer-Mediated Decay Mechanism of He+ in the Presence of Heavier Alkali Dimers

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2024-03, Vol.128 (11), p.1973-1983

2024

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Lifetime of inner-shell hole states of Ar (2p) and Kr (3d) using equation-of-motion coupled cluster method

The Journal of chemical physics, 2015-07, Vol.143 (2), p.024305-024305

2015

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Complex absorbing potential based equation-of-motion coupled cluster method for the potential energy curve of $\text{CO}_{2}^{-}$CO2− anion

The Journal of chemical physics, 2014-10, Vol.141 (16), p.164113

2014

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Mechanisms of one-photon two-site double ionization after resonant inner-valence excitation in Ne clusters

Physical review research, 2023-01, Vol.5 (1), Article 013055

2023

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Decay Processes in Cationic Alkali Metals in Microsolvated Clusters: A Complex Absorbing Potential Based Equation-of-Motion Coupled Cluster Investigation

Journal of chemical theory and computation, 2022-02, Vol.18 (2), p.807-816

2022

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Interatomic Coulombic decay in Neon-Helium cluster: a complex absorbing potential based equation-of-motion coupled cluster investigation

Molecular physics, 2021-05, Vol.119 (9), p.e1884300

2021

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Signature of the neighbor's quantum nuclear dynamics in the electron transfer mediated decay spectra

Chemical science (Cambridge), 2021-07, Vol.12 (27), p.9379-9385

2021

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Electron transfer mediated decay in HeLi 2 cluster: Potential energy surfaces and decay widths

The Journal of chemical physics, 2019-04, Vol.150 (16), p.164309

2019

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Auger decay rates of core hole states using equation of motion coupled cluster method

Chemical physics, 2017-01, Vol.482, p.160-164

2017

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Study of interatomic Coulombic decay of Ne(H2O)n (n = 1,3) clusters using equation-of-motion coupled-cluster method

The Journal of chemical physics, 2013-08, Vol.139 (6), p.064112-064112

2013

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Enhancing Diradical Character of Chichibabin's Hydrocarbon through Fluoride Substitution

ChemPlusChem (Weinheim, Germany), 2023-08, Vol.88 (8), p.e202300273-n/a

2023

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Complex absorbing potential based equation-of-motion coupled cluster method for the potential energy curve of CO₂⁻ anion

The Journal of chemical physics, 2014-10, Vol.141 (16), p.164113-164113

2014

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Complex absorbing potential based equation-of-motion coupled cluster method for the potential energy curve of CO{sub 2}{sup −} anion

The Journal of chemical physics, 2014-10, Vol.141 (16)

2014

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Interatomic Coulombic decay in (n = 2-3) clusters using CAP/EOM-CCSD method

Molecular physics, 2014-03, Vol.112 (5-6), p.669-673

2014

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Real-time observation of X-ray-induced intramolecular and interatomic electronic decay in CH2I2

Nature communications, 2019-05, Vol.10 (1), p.2186-2186, Article 2186

2019

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Constrained variational approach for energy derivatives in Intermediate Hamiltonian Fock-space coupled-cluster theory

Chemical physics, 2012-06, Vol.401, p.45-49

2012

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Extended coupled cluster through nth perturbation order for molecular response properties: A comparative study

Chemical physics, 2013-05, Vol.417, p.45-51

2013

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Relaxation of the 2a1 ionized water dimer: An interplay of intermolecular Coulombic decay (ICD) and proton transfer processes

Effect of charge and solvation shell on non-radiative decay processes in s-block cationic metal ion water clusters

Geometry-dependent lifetime of Interatomic coulombic decay using equation-of-motion coupled cluster method

Electron transfer mediated decay in HeLi2 cluster: Potential energy surfaces and decay widths

Attosecond spectroscopy reveals alignment dependent core-hole dynamics in the ICl molecule

Equation-of-motion coupled-cluster method for the study of shape resonance

Formaldehyde roaming dynamics: Comparison of quasi-classical trajectory calculations and experiments

CAP/EOM-CCSD method for the study of potential curves of resonant states

Full Dynamical and Ab Initio Investigation of the Electron Transfer-Mediated Decay Mechanism of He+ in the Presence of Heavier Alkali Dimers

Lifetime of inner-shell hole states of Ar (2p) and Kr (3d) using equation-of-motion coupled cluster method

Complex absorbing potential based equation-of-motion coupled cluster method for the potential energy curve of $\text{CO}_{2}^{-}$CO2− anion

Mechanisms of one-photon two-site double ionization after resonant inner-valence excitation in Ne clusters

Decay Processes in Cationic Alkali Metals in Microsolvated Clusters: A Complex Absorbing Potential Based Equation-of-Motion Coupled Cluster Investigation

Interatomic Coulombic decay in Neon-Helium cluster: a complex absorbing potential based equation-of-motion coupled cluster investigation

Signature of the neighbor's quantum nuclear dynamics in the electron transfer mediated decay spectra

Electron transfer mediated decay in HeLi 2 cluster: Potential energy surfaces and decay widths

Auger decay rates of core hole states using equation of motion coupled cluster method

Study of interatomic Coulombic decay of Ne(H2O)n (n = 1,3) clusters using equation-of-motion coupled-cluster method

Enhancing Diradical Character of Chichibabin's Hydrocarbon through Fluoride Substitution

Complex absorbing potential based equation-of-motion coupled cluster method for the potential energy curve of CO₂⁻ anion

Complex absorbing potential based equation-of-motion coupled cluster method for the potential energy curve of CO{sub 2}{sup −} anion

Interatomic Coulombic decay in (n = 2-3) clusters using CAP/EOM-CCSD method

Real-time observation of X-ray-induced intramolecular and interatomic electronic decay in CH2I2

Constrained variational approach for energy derivatives in Intermediate Hamiltonian Fock-space coupled-cluster theory

Extended coupled cluster through nth perturbation order for molecular response properties: A comparative study

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