Works matching IS 01928651 AND DT 2019 AND VI 40 AND IP 26

Results: 11

Exploring the Structure and Stability of Cholesterol Dimer Formation in Multicomponent Lipid Bilayers.

Published in:

2019

By:

Bandara, Asanga;
Panahi, Afra;
Pantelopulos, George A.;
Straub, John E.

Publication type:

Correction Notice

Noncovalent Complexes of the Noble‐Gas Atoms: Analyzing the Transition from Physical to Chemical Interactions.

Published in:

Journal of Computational Chemistry, 2019, v. 40, n. 26, p. 2318, doi. 10.1002/jcc.26010

By:

Borocci, Stefano;
Grandinetti, Felice;
Sanna, Nico;
Antoniotti, Paola;
Nunzi, Francesca

Publication type:

Article

The Role of Computational Chemistry in the Experimental Determination of the Dipole Moment of Molecules in Solution.

Published in:

Journal of Computational Chemistry, 2019, v. 40, n. 26, p. 2309, doi. 10.1002/jcc.26009

By:

Cammi, Roberto

Publication type:

Article

Magnetic Signatures of Hydroxyl‐ and Water‐Terminated Neutral and Tetra‐Anionic Mn<sub>12</sub>‐Acetate.

Published in:

Journal of Computational Chemistry, 2019, v. 40, n. 26, p. 2301, doi. 10.1002/jcc.26008

By:

Batool, Javaria;
Hahn, Torsten;
Pederson, Mark R.

Publication type:

Article

Superhalogen and Superacid.

Published in:

Journal of Computational Chemistry, 2019, v. 40, n. 26, p. 2293, doi. 10.1002/jcc.26007

By:

Kulsha, Andrey V.;
Sharapa, Dmitry I.

Publication type:

Article

Rational Design of Electronically Labile Dinuclear Fe and Co complexes with 1,10‐Phenanthroline‐5,6‐Diimine: A DFT study.

Published in:

Journal of Computational Chemistry, 2019, v. 40, n. 26, p. 2284, doi. 10.1002/jcc.26005

By:

Starikova, Alyona A.;
Chegerev, Maxim G.;
Starikov, Andrey G.;
Minkin, Vladimir I.

Publication type:

Article

MLatom: A program package for quantum chemical research assisted by machine learning.

Published in:

Journal of Computational Chemistry, 2019, v. 40, n. 26, p. 2339, doi. 10.1002/jcc.26004

By:

Dral, Pavlo O.

Publication type:

Article

CRYSPLOT: A new tool to visualize physical and chemical properties of molecules, polymers, surfaces, and crystalline solids.

Published in:

Journal of Computational Chemistry, 2019, v. 40, n. 26, p. 2329, doi. 10.1002/jcc.25858

By:

Beata, Giorgia;
Perego, Gianpaolo;
Civalleri, Bartolomeo

Publication type:

Article

Cover Image, Volume 40, Issue 26.

Published in:: Journal of Computational Chemistry, 2019, v. 40, n. 26, p. C1, doi. 10.1002/jcc.25464
Publication type:: Article

Issue Information.

Published in:: Journal of Computational Chemistry, 2019, v. 40, n. 26, p. 2243, doi. 10.1002/jcc.25504
Publication type:: Article

Nine questions on energy decomposition analysis.

Published in:

Journal of Computational Chemistry, 2019, v. 40, n. 26, p. 2248, doi. 10.1002/jcc.26003

By:

Andrés, Juan;
Ayers, Paul W.;
Boto, Roberto A.;
Carbó‐Dorca, Ramon;
Chermette, Henry;
Cioslowski, Jerzy;
Contreras‐García, Julia;
Cooper, David L.;
Frenking, Gernot;
Gatti, Carlo;
Heidar‐Zadeh, Farnaz;
Joubert, Laurent;
Martín Pendás, Ángel;
Matito, Eduard;
Mayer, István;
Misquitta, Alston J.;
Mo, Yirong;
Pilmé, Julien;
Popelier, Paul L. A.;
Rahm, Martin

Publication type:

Article