FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2039174443> ?p ?o ?g. }

• W2039174443 abstract "Small symmetric molecules and low-dimensional model Hamiltonians are excellent systems for benchmarking theories to compute tunneling splittings. In this work, we investigate a three dimensional model Hamiltonian coupled to a harmonic bath that describes concerted proton transfer in the formic acid dimer. The three modes include the symmetric proton stretch, the symmetric dimer rock, and the dimer stretch. These modes provide a paradigm for the symmetric and anti-symmetric coupled tunneling pathways, these being recognized in the literature as two of the more important classes of coupling. The effects of selective vibrational excitation and coupling to a bath on the tunneling splittings are presented. The splittings for highly excited states are computed using a novel method that makes an adiabatic approximation to the Herring estimate. Results, which are in excellent agreement with the exact splittings, are compared with those obtained using the Makri-Miller approach. This latter method has been shown to provide quality results for tunneling splittings including highly excited vibrational states." @default.
• W2039174443 created "2016-06-24" @default.
• W2039174443 creator A5030243146 @default.
• W2039174443 creator A5059968889 @default.
• W2039174443 date "2015-02-26" @default.
• W2039174443 modified "2023-09-27" @default.
• W2039174443 title "Tunneling splittings in formic acid dimer: An adiabatic approximation to the Herring formula" @default.
• W2039174443 cites W1532427289 @default.
• W2039174443 cites W1963781451 @default.
• W2039174443 cites W1964261493 @default.
• W2039174443 cites W1976896001 @default.
• W2039174443 cites W1977935512 @default.
• W2039174443 cites W1978015730 @default.
• W2039174443 cites W1978189969 @default.
• W2039174443 cites W1984596905 @default.
• W2039174443 cites W1985748667 @default.
• W2039174443 cites W1991706167 @default.
• W2039174443 cites W1998725374 @default.
• W2039174443 cites W2007446150 @default.
• W2039174443 cites W2016263510 @default.
• W2039174443 cites W2017158178 @default.
• W2039174443 cites W2019012502 @default.
• W2039174443 cites W2021979852 @default.
• W2039174443 cites W2026283112 @default.
• W2039174443 cites W2026809707 @default.
• W2039174443 cites W2032481420 @default.
• W2039174443 cites W2032497114 @default.
• W2039174443 cites W2032772416 @default.
• W2039174443 cites W2033788647 @default.
• W2039174443 cites W2048029291 @default.
• W2039174443 cites W2051613858 @default.
• W2039174443 cites W2057883753 @default.
• W2039174443 cites W2061193993 @default.
• W2039174443 cites W2063262828 @default.
• W2039174443 cites W2065664073 @default.
• W2039174443 cites W2069446818 @default.
• W2039174443 cites W2070521818 @default.
• W2039174443 cites W2075830208 @default.
• W2039174443 cites W2076066188 @default.
• W2039174443 cites W2077158914 @default.
• W2039174443 cites W2082343434 @default.
• W2039174443 cites W2085022730 @default.
• W2039174443 cites W2085793749 @default.
• W2039174443 cites W2086765210 @default.
• W2039174443 cites W2093099293 @default.
• W2039174443 cites W2099770169 @default.
• W2039174443 cites W2099879406 @default.
• W2039174443 cites W2105564187 @default.
• W2039174443 cites W2110456594 @default.
• W2039174443 cites W2144870776 @default.
• W2039174443 cites W2312775660 @default.
• W2039174443 cites W2325880496 @default.
• W2039174443 cites W2129486430 @default.
• W2039174443 doi "https://doi.org/10.1063/1.4908565" @default.
• W2039174443 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/25725720" @default.
• W2039174443 hasPublicationYear "2015" @default.
• W2039174443 type Work @default.
• W2039174443 sameAs 2039174443 @default.
• W2039174443 citedByCount "15" @default.
• W2039174443 countsByYear W20391744432015 @default.
• W2039174443 countsByYear W20391744432016 @default.
• W2039174443 countsByYear W20391744432017 @default.
• W2039174443 countsByYear W20391744432018 @default.
• W2039174443 countsByYear W20391744432019 @default.
• W2039174443 countsByYear W20391744432020 @default.
• W2039174443 countsByYear W20391744432023 @default.
• W2039174443 crossrefType "journal-article" @default.
• W2039174443 hasAuthorship W2039174443A5030243146 @default.
• W2039174443 hasAuthorship W2039174443A5059968889 @default.
• W2039174443 hasConcept C109663097 @default.
• W2039174443 hasConcept C120398109 @default.
• W2039174443 hasConcept C121332964 @default.
• W2039174443 hasConcept C126255220 @default.
• W2039174443 hasConcept C130787639 @default.
• W2039174443 hasConcept C147597530 @default.
• W2039174443 hasConcept C147724859 @default.
• W2039174443 hasConcept C178790620 @default.
• W2039174443 hasConcept C181500209 @default.
• W2039174443 hasConcept C185592680 @default.
• W2039174443 hasConcept C2779546866 @default.
• W2039174443 hasConcept C33923547 @default.
• W2039174443 hasConcept C40560622 @default.
• W2039174443 hasConcept C41999313 @default.
• W2039174443 hasConcept C62520636 @default.
• W2039174443 hasConceptScore W2039174443C109663097 @default.
• W2039174443 hasConceptScore W2039174443C120398109 @default.
• W2039174443 hasConceptScore W2039174443C121332964 @default.
• W2039174443 hasConceptScore W2039174443C126255220 @default.
• W2039174443 hasConceptScore W2039174443C130787639 @default.
• W2039174443 hasConceptScore W2039174443C147597530 @default.
• W2039174443 hasConceptScore W2039174443C147724859 @default.
• W2039174443 hasConceptScore W2039174443C178790620 @default.
• W2039174443 hasConceptScore W2039174443C181500209 @default.
• W2039174443 hasConceptScore W2039174443C185592680 @default.
• W2039174443 hasConceptScore W2039174443C2779546866 @default.
• W2039174443 hasConceptScore W2039174443C33923547 @default.
• W2039174443 hasConceptScore W2039174443C40560622 @default.
• W2039174443 hasConceptScore W2039174443C41999313 @default.
• W2039174443 hasConceptScore W2039174443C62520636 @default.
• W2039174443 hasFunder F4320306076 @default.

• next