Vanessa Labet

CEA

19H指数

55论文数

1.0K被引数

收录论文 9

发表时间

Expanding horizons in conceptual density functional theory: Novel ensembles and descriptors to decipher reactivity patterns

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2024-04-05

PREAI

Hoffmann, Guillaume; Guegan, Frederic; Labet, Vanessa; Joubert, Laurent; Chermette, Henry; Morell, Christophe; Tognetti, Vincent

Probing the in-air growth of large area of 3D functional structures into a 2D supramolecular nanoporous network

CHEMICAL COMMUNICATIONS

IF4.2

2018-01-01

OAAI

Brisse, Romain; Guianvarc'h, Dominique; Mansuy, Christelle; Sagan, Sandrine; Kreher, David; Sosa-Vargas, Lydia; Hamitouche, Lydia; Humblot, Vincent; Arfaoui, Imad; Labet, Vanessa; Paris, Celine; Petit, Christophe; Attias, Andre-Jean

Vibrational properties of silicates: A cluster model able to reproduce the effect of SiO4 polymerization on Raman intensities

JOURNAL OF NON-CRYSTALLINE SOLIDS

IF3.5

2013-06-01

OAAI

Labet, Vanessa; Colomban, Philippe

A fresh look at dense hydrogen under pressure. I. An introduction to the problem, and an index probing equalization of H-H distances

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2012-02-15

OAAI

Labet, Vanessa; Gonzalez-Morelos, Paulina; Hoffmann, Roald; Ashcroft, N. W.

A fresh look at dense hydrogen under pressure. III. Two competing effects and the resulting intra-molecular H-H separation in solid hydrogen under pressure

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2012-02-15

OAAI

Labet, Vanessa; Hoffmann, Roald; Ashcroft, N. W.

A fresh look at dense hydrogen under pressure. IV. Two structural models on the road from paired to monatomic hydrogen, via a possible non-crystalline phase

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2012-02-15

OAAI

Labet, Vanessa; Hoffmann, Roald; Ashcroft, N. W.

A fresh look at dense hydrogen under pressure. II. Chemical and physical models aiding our understanding of evolving H-H separations

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2012-02-15

OAAI

Labet, Vanessa; Hoffmann, Roald; Ashcroft, N. W.

Graphane sheets and crystals under pressure

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

IF9.1

2011-04-08

126

OAAI

Wen, Xiao-Dong; Hand, Louis; Labet, Vanessa; Yang, Tao; Hoffmann, Roald; Ashcroft, N. W.; Oganov, Artem R.; Lyakhov, Andriy O.

Characterization of the Chemical Behavior of the Low Excited States through a Local Chemical Potential

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2009-08-05

PREAI

Morell, Christophe; Labet, Vanessa; Grand, Andre; Ayers, Paul W.; De Proft, Frank; Geerlings, Paul; Chermette, Henry

研究方向