Johann Valentin Pototschnig

helmholtz association

12H指数

73论文数

327被引数

收录论文 7

发表时间

The CP2K Program Package Made Simple

Journal of Physical Chemistry B

IF2.9

2026-01-01

PREAI

Iannuzzi, Marcella; Wilhelm, Jan; Stein, Frederick; Bussy, Augustin; Elgabarty, Hossam; Golze, Dorothea; Hehn, Anna-Sophia; Graml, Maximilian; Marek, Stepan; Goekmen, Beliz Sertcan; Schran, Christoph; Forbert, Harald; Khaliullin, Rustam Z.; Kozhevnikov, Anton; Taillefumier, Mathieu; Meli, Rocco; Rybkin, Vladimir V.; Brehm, Martin; Schade, Robert; Schutt, Ole; Pototschnig, Johann V.; Mirhosseini, Hossein; Knuepfer, Andreas; Marx, Dominik; Krack, Matthias; Hutter, Jurg; Kuehne, Thomas D.

Generating Coupled Cluster Code for Modern Distributed-Memory Tensor Software 为现代分布式内存张量软件生成耦合簇代码

Journal of Chemical Theory and Computation

IF5.5

2025-07-18

OAAI

Jan Brandejs; Johann Pototschnig; Trond Saue

Beyond the Dailey-Townes Model: Chemical Information from the Electric Field Gradient 超越Dailey-Townes模型：电场梯度中的化学信息

JOURNAL OF PHYSICAL CHEMISTRY A

IF2.8

2025-01-17

OAAI

Fabbro, Gabriele; Pototschnig, Johann; Saue, Trond

Formulation and Implementation of Frequency-Dependent Linear Response Properties with Relativistic Coupled Cluster Theory for GPU-Accelerated Computer Architectures

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2024-01-09

OAAI

Yuan, Xiang; Halbert, Loic; Pototschnig, Johann Valentin; Papadopoulos, Anastasios; Coriani, Sonia; Visscher, Lucas; Gomes, Andre Severo Pereira

Implementation of Relativistic Coupled Cluster Theory for Massively Parallel GPU-Accelerated Computing Architectures

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2021-08-09

OAAI

Pototschnig, Johann, V; Papadopoulos, Anastasios; Lyakh, Dmitry, I; Repisky, Michal; Halbert, Loic; Gomes, Andre Severo Pereira; Jensen, Hans Jorgen Aa; Visscher, Lucas

Spectroscopy of gold atoms and gold oligomers in helium nanodroplets

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2018-07-12

OAAI

Messner, Roman; Schiffmann, Alexander; Pototschnig, Johann V.; Lasserus, Maximilian; Schnedlitz, Martin; Lackner, Florian; Ernst, Wolfgang E.

Ab initio study of the RbSr electronic structure: Potential energy curves, transition dipole moments, and permanent electric dipole moments

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2014-12-17

PREAI

Pototschnig, Johann V.; Krois, Guenter; Lackner, Florian; Ernst, Wolfgang E.

研究方向