| scholarly article | Q13442814 |
| P50 | author | Paul M Zimmerman | Q57517853 |
| P2093 | author name string | Cody Aldaz | |
| Joshua A Kammeraad | |||
| P2860 | cites work | A growing string method for determining transition states: comparison to the nudged elastic band and string methods | Q28273262 |
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| Automated Search for Minimum Energy Conical Intersection Geometries between the Lowest Two Singlet States S0/S1-MECIs by the Spin-Flip TDDFT Method | Q40291486 | ||
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| Automated discovery of chemically reasonable elementary reaction steps | Q45819255 | ||
| Benign decay vs. photolysis in the photophysics and photochemistry of 5-bromouracil. A computational study | Q46047111 | ||
| On the extent and connectivity of conical intersection seams and the effects of three-state intersections | Q46243983 | ||
| Modeling the photophysics and photochromic potential of 1,2-dihydronaphthalene (DHN): a combined CASPT2//CASSCF-topological and MMVB-dynamical investigation | Q46374174 | ||
| Analytical State-Average Complete-Active-Space Self-Consistent Field Nonadiabatic Coupling Vectors: Implementation with Density-Fitted Two-Electron Integrals and Application to Conical Intersections | Q46433534 | ||
| Intramolecular charge transfer in 4-aminobenzonitriles does not necessarily need the twist | Q46482889 | ||
| An extended conical intersection seam associated with a manifold of decay paths: excited-state intramolecular proton transfer in O-hydroxybenzaldehyde | Q46600308 | ||
| A direct method for locating minimum-energy crossing points (MECPs) in spin-forbidden transitions and nonadiabatic reactions | Q46704587 | ||
| Optimizing conical intersections without derivative coupling vectors: application to multistate multireference second-order perturbation theory (MS-CASPT2). | Q46849418 | ||
| Exploration of minimum energy conical intersection structures of small polycyclic aromatic hydrocarbons: toward an understanding of the size dependence of fluorescence quantum yields | Q47368728 | ||
| Reliable and efficient reaction path and transition state finding for surface reactions with the growing string method. | Q48048716 | ||
| Estimating the Derivative Coupling Vector Using Gradients. | Q48052011 | ||
| Rich Athermal Ground-State Chemistry Triggered by Dynamics through a Conical Intersection. | Q48053681 | ||
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| Systematic exploration of minimum energy conical intersection structures near the Franck-Condon region. | Q51032512 | ||
| Dynamics at Conical Intersections. | Q51410465 | ||
| Finding Minimum Structures on the Seam of Crossing in Reactions of Type A + B → X: Exploration of Nonadiabatic Ignition Pathways of Unsaturated Hydrocarbons. | Q51608255 | ||
| Updated Branching Plane for Finding Conical Intersections without Coupling Derivative Vectors. | Q51612718 | ||
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| Highly Active Nickel Catalysts for C-H Functionalization Identified through Analysis of Off-Cycle Intermediates. | Q53660633 | ||
| Conical intersections as a mechanistic feature of organic photochemistry | Q59463765 | ||
| Quadratic Description of Conical Intersections: Characterization of Critical Points on the Extended Seam | Q62514075 | ||
| Mechanism of an Exceptional Class of Photostabilizers: A Seam of Conical Intersection Parallel to Excited State Intramolecular Proton Transfer (ESIPT) ino-Hydroxyphenyl-(1,3,5)-triazine | Q62514089 | ||
| Efficient Photochemical Merocyanine-to-Spiropyran Ring Closure Mechanism through an Extended Conical Intersection Seam. A Model CASSCF/CASPT2 Study | Q63434716 | ||
| Chemistry. Roaming reaction pathways along excited states | Q83556351 | ||
| Single-ended transition state finding with the growing string method | Q86514291 | ||
| Studies of the Mechanism and Origins of Enantioselectivity for the Chiral Phosphoric Acid-Catalyzed Stereoselective Spiroketalization Reactions | Q86863545 | ||
| Accurate nonadiabatic dynamics | Q88499382 | ||
| P433 | issue | 43 | |
| P407 | language of work or name | English | Q1860 |
| P304 | page(s) | 27394-27405 | |
| P577 | publication date | 2018-11-01 | |
| P1433 | published in | Physical Chemistry Chemical Physics | Q3018671 |
| P1476 | title | Discovery of conical intersection mediated photochemistry with growing string methods | |
| P478 | volume | 20 |
| Q89856513 | What Does the Machine Learn? Knowledge Representations of Chemical Reactivity | cites work | P2860 |
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