Wesley D. Allen - Publications & Citations

Wesley D. Allen

university of georgia

0H指数

1论文数

0被引数

收录论文 76

发表时间

Concordant Mode Approach (CMA): Vibrational Analysis of New and Upgraded Intermolecular Benchmarks for Noncovalent Bonding CMA方法：用于非共价键的新和升级的分子间基准模型的振动分析

The Journal of Physical Chemistry A

IF2.8

2026-04-13

OAAI

Laura N. Olive Dornshuld; Mitchell E. Lahm; Nathaniel L. Kitzmiller; Wesley D. Allen; Henry F. Schaefer III

Tight junction membrane protein's role in neural tube defects

FASEB JOURNAL

IF4.2

2022-05-13

PREAI

Mizrachi, Dario; Allen, Wesley

The multichannel n-propyl + O2 reaction surface: Definitive theory on a model hydrocarbon oxidation mechanism

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2018-03-02

OAAI

Bartlett, Marcus A.; Liang, Tao; Pu, Liang; Schaefer, Henry F.; Allen, Wesley D.

Polytriangulane

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2016-08-25

PREAI

Allen, Wesley D.; Quanz, Henrik; Schreiner, Peter R.

Conformers of Gaseous Serine

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2016-07-20

PREAI

He, Kedan; Allen, Wesley D.

Sub-Doppler infrared spectroscopy and formation dynamics of triacetylene in a slit supersonic expansion

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2016-02-17

OAAI

Chang, Chih-Hsuan; Agarwal, Jay; Allen, Wesley D.; Nesbitt, David J.

Domino Tunneling

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

IF15.6

2015-06-15

PREAI

Schreiner, Peter R.; Wagner, J. Philipp; Reisenauer, Hans Peter; Gerbig, Dennis; Ley, David; Sarka, Janos; Csaszar, Attila G.; Vaughn, Alexander; Allen, Wesley D.

The electronic structure of vanadium monochloride cation (VCl+): Tackling the complexities of transition metal species

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2014-11-24

PREAI

DeYonker, Nathan J.; Halfen, DeWayne T.; Allen, Wesley D.; Ziurys, Lucy M.

Do π-Conjugative Effects Facilitate SN2 Reactions?

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

IF15.6

2014-02-13

PREAI

Wu, Chia-Hua; Galabov, Boris; Wu, Judy I-Chia; Ilieva, Sonia; Schleyer, Paul von R.; Allen, Wesley D.

π-Complexation in Nickel-Catalyzed Cross-Coupling Reactions

JOURNAL OF ORGANIC CHEMISTRY

IF3.6

2014-02-10

PREAI

Sontag, S. Kyle; Bilbrey, Jenna A.; Huddleston, N. Eric; Sheppard, Gareth R.; Allen, Wesley D.; Locklin, Jason

Polytwistane

CHEMISTRY-A EUROPEAN JOURNAL

IF3.7

2014-01-08

PREAI

Barua, Shiblee R.; Quanz, Henrik; Olbrich, Martin; Schreiner, Peter R.; Trauner, Dirk; Allen, Wesley D.

Exact Ligand Solid Angles

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2013-11-21

PREAI

Bilbrey, Jenna A.; Kazez, Arianna H.; Locklin, Jason; Allen, Wesley D.

Nearly Degenerate Isomers of C(BH)2: Cumulene, Carbene, or Carbone?

CHEMISTRY-A EUROPEAN JOURNAL

IF3.7

2013-10-07

PREAI

Barua, Shiblee R.; Allen, Wesley D.; Kraka, Elfi; Jerabek, Paul; Sure, Rebecca; Frenking, Gernot

Free Cyclooctatetraene Dianion: Planarity, Aromaticity, and Theoretical Challenges

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2013-09-17

PREAI

Sokolov, Alexander Yu.; Magers, D. Brandon; Wu, Judy I.; Allen, Wesley D.; Schleyer, Paul v R.; Schaefer, Henry F., III

Exact ligand cone angles

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2013-02-13

147

PREAI

Bilbrey, Jenna A.; Kazez, Arianna H.; Locklin, Jason; Allen, Wesley D.

Taming the low-lying electronic states of FeH

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2012-12-18

PREAI

DeYonker, Nathan J.; Allen, Wesley D.

Structure-reactivity relationships for aromatic molecules: electrostatic potentials at nuclei and electrophile affinity indices

WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE

IF27

2012-08-08

PREAI

Galabov, Boris; Ilieva, Sonia; Koleva, Gergana; Allen, Wesley D.; Schaefer, Henry F., III; Schleyer, Paul von R.

PSI4: an open-source ab initio electronic structure program

WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE

IF27

2011-10-31

1.0K

PREAI

Turney, Justin M.; Simmonett, Andrew C.; Parrish, Robert M.; Hohenstein, Edward G.; Evangelista, Francesco A.; Fermann, Justin T.; Mintz, Benjamin J.; Burns, Lori A.; Wilke, Jeremiah J.; Abrams, Micah L.; Russ, Nicholas J.; Leininger, Matthew L.; Janssen, Curtis L.; Seidl, Edward T.; Allen, Wesley D.; Schaefer, Henry F.; King, Rollin A.; Valeev, Edward F.; Sherrill, C. David; Crawford, T. Daniel

Lowest-Lying Conformers of Alanine: Pushing Theory to Ascertain Precise Energetics and Semiexperimental Re Structures

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2010-09-23

PREAI

Jaeger, Heather M.; Schaefer, Henry F., III; Demaison, Jean; Csaszar, Attila G.; Allen, Wesley D.

Assigning quantum labels to variationally computed rotational-vibrational eigenstates of polyatomic molecules

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2010-07-20

PREAI

Matyus, Edit; Fabri, Csaba; Szidarovszky, Tamas; Czako, Gabor; Allen, Wesley D.; Csaszar, Attila G.

研究方向