Theoretical studies on electron delocalization in diaminoguanidine

Prasad V. Bharatam; Pansy Iqbal

doi:10.1002/jcc.20338

Theoretical studies on electron delocalization in diaminoguanidine

Journal of Computational Chemistry ◽

10.1002/jcc.20338 ◽

2006 ◽

Vol 27 (3) ◽

pp. 334-343 ◽

Cited By ~ 7

Author(s):

Prasad V. Bharatam ◽

Pansy Iqbal

Keyword(s):

Electron Delocalization ◽

Theoretical Studies

Download Full-text

Theoretical studies of π-electron delocalization and localization on intramolecular proton transfer in the ground state

Journal of Molecular Structure ◽

10.1016/j.molstruc.2017.10.079 ◽

2018 ◽

Vol 1154 ◽

pp. 590-595 ◽

Cited By ~ 13

Author(s):

Hongliang Peng ◽

Pengru Huang ◽

Pinggui Yi ◽

Fen Xu ◽

Lixian Sun

Keyword(s):

Proton Transfer ◽

Ground State ◽

Intramolecular Proton Transfer ◽

Electron Delocalization ◽

Theoretical Studies

Download Full-text

Bis(tetrathiafulvalenes) with aromatic bridges: electron delocalization in the oxidized species through EPR and theoretical studies

Physical Chemistry Chemical Physics ◽

10.1039/c001014f ◽

2010 ◽

Vol 12 (33) ◽

pp. 9650 ◽

Cited By ~ 10

Author(s):

François Riobé ◽

Narcis Avarvari ◽

Philippe Grosshans ◽

Helena Sidorenkova ◽

Théo Berclaz ◽

...

Keyword(s):

Electron Delocalization ◽

Theoretical Studies

Download Full-text

Theoretical studies on the role of π-electron delocalization in determining the conformation of N-benzylideneaniline with three types of LMO basis sets

Journal of Computational Chemistry ◽

10.1002/jcc.20390 ◽

2006 ◽

Vol 27 (7) ◽

pp. 809-824 ◽

Cited By ~ 7

Author(s):

Peng Bao ◽

Zhong-Heng Yu

Keyword(s):

Basis Sets ◽

Electron Delocalization ◽

Theoretical Studies

Download Full-text

Theoretical Studies of Steric Effects on Intraligand Electron Delocalization: Implications for the Temporal Evolution of MLCT Excited States

The Journal of Physical Chemistry A ◽

10.1021/jp9805095 ◽

1998 ◽

Vol 102 (19) ◽

pp. 3382-3397 ◽

Cited By ~ 41

Author(s):

Niels H. Damrauer ◽

Brandon T. Weldon ◽

James K. McCusker

Keyword(s):

Excited States ◽

Temporal Evolution ◽

Electron Delocalization ◽

Steric Effects ◽

Theoretical Studies

Download Full-text

Theoretical studies for scanning tunneling microscopy

Physica B Condensed Matter ◽

10.1016/s0921-4526(84)91660-0 ◽

1984 ◽

Vol 127 (1-3) ◽

pp. 137-142 ◽

Cited By ~ 20

Author(s):

N GARCIA ◽

F FLORES

Keyword(s):

Scanning Tunneling Microscopy ◽

Scanning Tunneling ◽

Theoretical Studies ◽

Tunneling Microscopy

Download Full-text

Review for "Theoretical studies on space debris recycling and energy conversion system in the International Space Station"

10.1002/eng2.12317/v1/review2 ◽

2020 ◽

Author(s):

Egor Loktionov

Keyword(s):

Energy Conversion ◽

International Space Station ◽

Space Debris ◽

Space Station ◽

Theoretical Studies ◽

International Space ◽

Conversion System ◽

Energy Conversion System

Download Full-text

Review of Psychoanalysis and the Nuclear Threat: Clinical and Theoretical Studies.

Contemporary Psychology ◽

10.1037/028302 ◽

1990 ◽

Vol 35 (2) ◽

pp. 185-185

Author(s):

Robert R. Holt

Keyword(s):

Theoretical Studies ◽

Nuclear Threat

Download Full-text

Theoretical studies of the ferroelectric transition

Uspekhi Fizicheskih Nauk ◽

10.3367/ufnr.0179.200906g.0639 ◽

2009 ◽

Vol 179 (6) ◽

pp. 639 ◽

Cited By ~ 4

Author(s):

Evgenii G. Maksimov

Keyword(s):

Theoretical Studies ◽

Ferroelectric Transition

Download Full-text

ACCURATE EQUILIBRIUM STRUCTURES FOR trans-HEXATRIENE BY THE MIXED ESTIMATION METHOD AND FOR THE THREE ISOMERS OF OCTATETRAENE FROM THEORY; STRUCTURAL CONSEQUENCES OF ELECTRON DELOCALIZATION

Proceedings of the 70th International Symposium on Molecular Spectroscopy ◽

10.15278/isms.2015.mg04 ◽

2015 ◽

Author(s):

Norman Craig ◽

Natalja Vogt ◽

Heinz Rudolph ◽

Peter Groner ◽

Jean Demaison

Keyword(s):

Estimation Method ◽

Electron Delocalization ◽

Equilibrium Structures ◽

Mixed Estimation

Download Full-text

INFLUENCE OF 5-HALOGENATION ON THE STRUCTURE OF PROTONATED URIDINE: IRMPD ACTION SPECTROSCOPY AND THEORETICAL STUDIES OF THE PROTONATED 5-HALOURIDINES

Proceedings of the 71st International Symposium on Molecular Spectroscopy ◽

10.15278/isms.2016.mh15 ◽

2016 ◽

Author(s):

Harrison Roy ◽

Jos Oomens ◽

Giel Berden ◽

M Rodgers ◽

Justin Lee ◽

...

Keyword(s):

Theoretical Studies ◽

Action Spectroscopy

Download Full-text