Free Energy Calculations and Conformational Analysis of Dibenzo-30-crown-10 with Sm2+, Eu2+, and Three Halide Salts in THF Using the AMOEBA Force Field

Journal article

Peer reviewed

Hesam Arabzadeh, Joseph M Sperling, Orlando Acevedo and Thomas E Albrecht-Schönzart

The journal of physical chemistry. B

2023-06-13

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Collaboration types: Domestic collaboration
Citation topics: 2 Chemistry; 2.59 Pigments, Sensors & Probes; 2.59.684 Ion-Selective Electrodes
Web Of Science research areas: Chemistry, Physical
ESI research areas: Chemistry

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Title: Free Energy Calculations and Conformational Analysis of Dibenzo-30-crown-10 with Sm2+, Eu2+, and Three Halide Salts in THF Using the AMOEBA Force Field
Creators: Hesam Arabzadeh - Florida State University
Joseph M Sperling - Florida State University
Orlando Acevedo - University of Miami
Thomas E Albrecht-Schönzart
Publication Details: The journal of physical chemistry. B
Academic Unit: A&S - Chemistry; College of A&S
Language: English
Resource Type: Journal article
Record Identifier: 991031811102502976