Solvatipn of excess electrons in supercritical ammonia
Solvation of excess electrons in supercritical ammonia along the T = 450 K isotherm was investigated. Equilibrium aspects of solvation were analyzed using combined path integral-molecular dynamics techniques. Observations showed transition from localized to quasifree states at approximately one four...
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todo:paper_00219606_v119_n12_p6044_Rodriguez2023-10-03T14:24:04Z Solvatipn of excess electrons in supercritical ammonia Rodriguez, J. Skaf, M.S. Laria, D. Electrons Ground state Molecular dynamics Supercritical fluids Solvation Ammonia Solvation of excess electrons in supercritical ammonia along the T = 450 K isotherm was investigated. Equilibrium aspects of solvation were analyzed using combined path integral-molecular dynamics techniques. Observations showed transition from localized to quasifree states at approximately one fourth of the triple point density. Fil:Rodriguez, J. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina. Fil:Laria, D. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina. JOUR info:eu-repo/semantics/openAccess http://creativecommons.org/licenses/by/2.5/ar http://hdl.handle.net/20.500.12110/paper_00219606_v119_n12_p6044_Rodriguez |
institution |
Universidad de Buenos Aires |
institution_str |
I-28 |
repository_str |
R-134 |
collection |
Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) |
topic |
Electrons Ground state Molecular dynamics Supercritical fluids Solvation Ammonia |
spellingShingle |
Electrons Ground state Molecular dynamics Supercritical fluids Solvation Ammonia Rodriguez, J. Skaf, M.S. Laria, D. Solvatipn of excess electrons in supercritical ammonia |
topic_facet |
Electrons Ground state Molecular dynamics Supercritical fluids Solvation Ammonia |
description |
Solvation of excess electrons in supercritical ammonia along the T = 450 K isotherm was investigated. Equilibrium aspects of solvation were analyzed using combined path integral-molecular dynamics techniques. Observations showed transition from localized to quasifree states at approximately one fourth of the triple point density. |
format |
JOUR |
author |
Rodriguez, J. Skaf, M.S. Laria, D. |
author_facet |
Rodriguez, J. Skaf, M.S. Laria, D. |
author_sort |
Rodriguez, J. |
title |
Solvatipn of excess electrons in supercritical ammonia |
title_short |
Solvatipn of excess electrons in supercritical ammonia |
title_full |
Solvatipn of excess electrons in supercritical ammonia |
title_fullStr |
Solvatipn of excess electrons in supercritical ammonia |
title_full_unstemmed |
Solvatipn of excess electrons in supercritical ammonia |
title_sort |
solvatipn of excess electrons in supercritical ammonia |
url |
http://hdl.handle.net/20.500.12110/paper_00219606_v119_n12_p6044_Rodriguez |
work_keys_str_mv |
AT rodriguezj solvatipnofexcesselectronsinsupercriticalammonia AT skafms solvatipnofexcesselectronsinsupercriticalammonia AT lariad solvatipnofexcesselectronsinsupercriticalammonia |
_version_ |
1782031021588348928 |