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Hydrogen‐Bond Network Determines the Early Photoisomerization Processes of Cph1 and AnPixJ Phytochromes

Angewandte Chemie International Edition, 2021-08, Vol.60 (34), p.18688-18693

International ed. in English, 2021

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Short-time dynamics of 2-thiouracil in the light absorbing S2(ππ(∗)) state

The Journal of chemical physics, 2015-11, Vol.143 (17), p.175103-175103

2015

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Theoretical Studies on the Excited-State Decay Mechanism of Homomenthyl Salicylate in a Gas Phase and an Acetonitrile Solution

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2022-01, Vol.126 (1), p.16-28

2022

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Quantum Mechanics/Molecular Mechanics Studies on the Photophysical Mechanism of Methyl Salicylate

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-03, Vol.125 (9), p.1880-1891

2021

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Solvent-dependent structural dynamics of 2(1H)-pyridinone in light absorbing S4(ππ) state

Journal of Raman spectroscopy, 2016-03, Vol.47 (3), p.299-309

2016

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Pt–S Bond-Enabled Temperature-Dependent Phosphorescence in S‑Heteroaryl Tetradentate Pt(S^C^N^O) Complexes

Inorganic chemistry, 2024-05, Vol.63 (19), p.8822-8831

2024

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Nonadiabatic Dynamics Simulations on Early-Time Photochemistry of Spirobenzopyran

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2020-04, Vol.124 (13), p.2547-2559

2020

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High-Lying 31Ag Dark-State-Mediated Singlet Fission

Journal of the American Chemical Society, 2021-04, Vol.143 (15), p.5691-5697

2021

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Quantum mechanics/molecular mechanics studies on the mechanistic photophysics of sunscreen oxybenzone in methanol solution

Physical chemistry chemical physics : PCCP, 2022-06, Vol.24 (21), p.13293-1334

2022

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Quantum mechanics/molecular mechanics studies on mechanistic photophysics of cytosine aza-analogues: 2,4-diamino-1,3,5-triazine and 2-amino-1,3,5-triazine in aqueous solution

Physical chemistry chemical physics : PCCP, 2023-03, Vol.25 (11), p.7669-768

2023

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Organic Thermometers Based on Aggregation of Difluoroboron β‑Diketonate Chromophores

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2020-12, Vol.124 (48), p.10082-10089

2020

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Hydrogen-Bonding Interaction Regulates Photoisomerization of a Single-Bond-Rotation Locked Photoactive Yellow Protein Chromophore in Protein

The journal of physical chemistry letters, 2020-04, Vol.11 (7), p.2470-2476

2020

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Quantum mechanics/molecular mechanics studies on the excited-state decay mechanisms of cytidine aza-analogues: 5-azacytidine and 2′-deoxy-5-azacytidine in aqueous solution

Physical chemistry chemical physics : PCCP, 2023-10, Vol.25 (38), p.26258-26269

2023

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CASPT2//CASSCF studies on mechanistic photophysics of 3-hydroxyflavone

Chemical physics, 2023-11, Vol.575, p.112056, Article 112056

2023

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Understanding the Excited-State Relaxation Mechanisms of Xanthophyll Lutein by Multi-configurational Electronic Structure Calculations

Journal of chemical information and modeling, 2023-08, Vol.63 (15), p.4679-4690

2023

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Mechanistic Photophysics of Tellurium-Substituted Uracils: Insights from Multistate Complete-Active-Space Second-Order Perturbation Calculations

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-10, Vol.125 (40), p.8816-8826

2021

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Quantum mechanics/molecular mechanics studies on excited state decay pathways of 5-azacytosine in aqueous solution

Physical chemistry chemical physics : PCCP, 2022-11, Vol.24 (45), p.27793-2783

2022

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Selenium substitution effects on excited-state properties and photophysics of uracil: a MS-CASPT2 study

Physical chemistry chemical physics : PCCP, 2020-06, Vol.22 (21), p.1212-12128

2020

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Stereoselective Excited-State Isomerization and Decay Paths in cis-Cyclobiazobenzene

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2019-07, Vol.123 (29), p.6144-6151

2019

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MS-CASPT2 studies on the mechanistic photophysics of tellurium-substituted guanine and cytosine

Physical chemistry chemical physics : PCCP, 2021-06, Vol.23 (21), p.12421-1243

2021

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QM/MM studies on the excited-state relaxation mechanism of a semisynthetic dTPT3 base

Physical chemistry chemical physics : PCCP, 2018, Vol.20 (7), p.5067-5073

2018

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Theoretical studies on the photochemistry of 2-nitrofluorene in the gas phase and acetonitrile solution

Physical chemistry chemical physics : PCCP, 2020-08, Vol.22 (29), p.16772-16782

2020

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Conformational distortion-harnessed singlet fission dynamics in thienoquinoid: rapid generation and subsequent annihilation of multiexciton dark state

Journal of materials chemistry. C, Materials for optical and electronic devices, 2022-03, Vol.1 (11), p.4268-4275

2022

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Short-time dynamics and decay mechanism of 2(1H)-pyridinone upon excitation to the light-absorbing S4( 2 1 ) state

The Journal of chemical physics, 2017-03, Vol.146 (11), p.114305-114305

2017

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Hydrogen‐Bond Network Determines the Early Photoisomerization Processes of Cph1 and AnPixJ Phytochromes

Angewandte Chemie, 2021-08, Vol.133 (34), p.18836-18841

2021

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Hydrogen‐Bond Network Determines the Early Photoisomerization Processes of Cph1 and AnPixJ Phytochromes

Short-time dynamics of 2-thiouracil in the light absorbing S2(ππ(∗)) state

Theoretical Studies on the Excited-State Decay Mechanism of Homomenthyl Salicylate in a Gas Phase and an Acetonitrile Solution

Quantum Mechanics/Molecular Mechanics Studies on the Photophysical Mechanism of Methyl Salicylate

Solvent-dependent structural dynamics of 2(1H)-pyridinone in light absorbing S4(ππ) state

Pt–S Bond-Enabled Temperature-Dependent Phosphorescence in S‑Heteroaryl Tetradentate Pt(S^C^N^O) Complexes

Nonadiabatic Dynamics Simulations on Early-Time Photochemistry of Spirobenzopyran

High-Lying 31Ag Dark-State-Mediated Singlet Fission

Quantum mechanics/molecular mechanics studies on the mechanistic photophysics of sunscreen oxybenzone in methanol solution

Quantum mechanics/molecular mechanics studies on mechanistic photophysics of cytosine aza-analogues: 2,4-diamino-1,3,5-triazine and 2-amino-1,3,5-triazine in aqueous solution

Organic Thermometers Based on Aggregation of Difluoroboron β‑Diketonate Chromophores

Hydrogen-Bonding Interaction Regulates Photoisomerization of a Single-Bond-Rotation Locked Photoactive Yellow Protein Chromophore in Protein

Quantum mechanics/molecular mechanics studies on the excited-state decay mechanisms of cytidine aza-analogues: 5-azacytidine and 2′-deoxy-5-azacytidine in aqueous solution

CASPT2//CASSCF studies on mechanistic photophysics of 3-hydroxyflavone

Understanding the Excited-State Relaxation Mechanisms of Xanthophyll Lutein by Multi-configurational Electronic Structure Calculations

Mechanistic Photophysics of Tellurium-Substituted Uracils: Insights from Multistate Complete-Active-Space Second-Order Perturbation Calculations

Quantum mechanics/molecular mechanics studies on excited state decay pathways of 5-azacytosine in aqueous solution

Selenium substitution effects on excited-state properties and photophysics of uracil: a MS-CASPT2 study

Stereoselective Excited-State Isomerization and Decay Paths in cis-Cyclobiazobenzene

MS-CASPT2 studies on the mechanistic photophysics of tellurium-substituted guanine and cytosine

QM/MM studies on the excited-state relaxation mechanism of a semisynthetic dTPT3 base

Theoretical studies on the photochemistry of 2-nitrofluorene in the gas phase and acetonitrile solution

Conformational distortion-harnessed singlet fission dynamics in thienoquinoid: rapid generation and subsequent annihilation of multiexciton dark state

Short-time dynamics and decay mechanism of 2(1H)-pyridinone upon excitation to the light-absorbing S4( 2 1 ) state

Hydrogen‐Bond Network Determines the Early Photoisomerization Processes of Cph1 and AnPixJ Phytochromes

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