You are on the new improved site. You can view the old site in view-only mode here until June 27, 2026

Filter Results

Search all journals

Enter search terms…

Advanced search

/

About

About Sage
About Sage Journals
Privacy Policy
Terms of Use
Contact Us
Help

Information for

Authors
Editors
Librarians
Researchers
Reviewers
Frequently asked questions

Copyright © 2026 by Sage Publications.京ICP备09090397号-11

Search results

Search results page

Articles (115)

Journals (0)

1-10 of 115 results for semi-empirical calculation

Sort by:

Relevance

Select all

Select all

Sort by:

Relevance

Select article: Adsorption of Phenols from Different Solvents on Graphene: Semi-Empirical Quantum Mechanical Calculations

Free access

Research article

First published 2013-4

Adsorption of Phenols from Different Solvents on Graphene: Semi-Empirical Quantum Mechanical Calculations

Pablo Húmpola, Héctor S. Odetti, Alberto G. Albesa [...]

Adsorption Science & Technology

Select article: An Electrospray Ionization Fourier Transform Ion Cyclotron Resonance Mass Spectrometry Study of 1,6-Methano[60]Fullerene-61,61-Dicarboxylic Acid

Retricted access

Research article

First published 2000-4

An Electrospray Ionization Fourier Transform Ion Cyclotron Resonance Mass Spectrometry Study of 1,6-Methano[60]Fullerene-61,61-Dicarboxylic Acid

Rui Zhang, Keith J. Fisher, Derek R. Smith [...]

European Journal of Mass Spectrometry

Select article: Study of Ion—Molecule Reactions and Collisionally-Activated Dissociation of Dopamine and Adrenaline by an Ion Trap Mass Spectrometer with An External Ionization Source

Retricted access

Research article

First published 2000-2

Study of Ion—Molecule Reactions and Collisionally-Activated Dissociation of Dopamine and Adrenaline by an Ion Trap Mass Spectrometer with An External Ionization Source

Hui-Fen Wu, Ya-Ping Lin

European Journal of Mass Spectrometry

Select article: Prediction of the Ultraviolet–Visible Absorption Spectra of Polycyclic Aromatic Hydrocarbons (Dibenzo and Naphtho) Derivatives of Fluoranthene

Retricted access

Research article

First published 2017-6

Prediction of the Ultraviolet–Visible Absorption Spectra of Polycyclic Aromatic Hydrocarbons (Dibenzo and Naphtho) Derivatives of Fluoranthene

Jorge O. Oña-Ruales, Yosadara Ruiz-Morales

Applied Spectroscopy

Select article: Synthesis of annularly functionalised BINOL-based chiral cyclophanes

Free access

Research article

First published 2006-10

Synthesis of annularly functionalised BINOL-based chiral cyclophanes

Muthialu Srisailas, Perumal Rajakumar

Journal of Chemical Research

Select article: AM1 Study of [C,C] 8 Carbo- and [C,H] 8 Carbo-cyclooctatetraene and Smaller Carbomers †

Free access

Research article

First published 1999-2

AM1 Study of [C,C] 8 Carbo- and [C,H] 8 Carbo-cyclooctatetraene and Smaller Carbomers †

Issa Yavari, Arash Jabbari, Marjaneh Samadizadeh

Journal of Chemical Research

Select article: Experimental and Computational Studies on the Electronic Spectral properties of Some 3-Hydroxy,4-Arylazo [(Benzylidene) Dithio] Diacetic Acids

Free access

Research article

First published 2003-4

Experimental and Computational Studies on the Electronic Spectral properties of Some 3-Hydroxy,4-Arylazo [(Benzylidene) Dithio] Diacetic Acids

Gamal A. Gohar

Journal of Chemical Research

Select article: Interfacial Energy of Dislocation and of Coherent Interphase Boundaries

Retricted access

Research article

First published 1968-1

Interfacial Energy of Dislocation and of Coherent Interphase Boundaries

H. I. Aaronson, J. B. Clark, C. Laird

Materials Science and Technology

Select article: Sound Fields in and around Railway Line Cuttings

Retricted access

Research article

First published 2009-10

Sound Fields in and around Railway Line Cuttings

Kurt Heutschi

Noise & Vibration Worldwide

Select article: Integral formulation of balance equations for two-phase flow through a sudden enlargement Part 2: A new interlocked volumes semi-empirical model

Retricted access

Research article

First published 1997-5

Integral formulation of balance equations for two-phase flow through a sudden enlargement Part 2: A new interlocked volumes semi-empirical model

A Attou, L Bolle

Proceedings of the Institution of Mechanical Engineers,Part C: Journal of Mechanical Engineering Science

1
2
3
•••
12
10 / page

Article type

Publication date

Subjects

Access