Publication data for: "Evaporation and Fragmentation of Organic Molecules in Strong Electric Fields Simulated with DFT" - data from Kästner group (ICPSR doi:10.18419/darus-1459)

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Document Description

Citation

Title:

Publication data for: "Evaporation and Fragmentation of Organic Molecules in Strong Electric Fields Simulated with DFT" - data from Kästner group

Identification Number:

doi:10.18419/darus-1459

Distributor:

DaRUS

Date of Distribution:

2021-04-14

Version:

1

Bibliographic Citation:

Dietrich, Carolin; Schuldt, Robin; Born, Daniel; Solodenko, Helena; Schmitz, Guido; Kästner, Johannes, 2021, "Publication data for: "Evaporation and Fragmentation of Organic Molecules in Strong Electric Fields Simulated with DFT" - data from Kästner group", https://doi.org/10.18419/darus-1459, DaRUS, V1

Study Description

Citation

Title:

Publication data for: "Evaporation and Fragmentation of Organic Molecules in Strong Electric Fields Simulated with DFT" - data from Kästner group

Identification Number:

doi:10.18419/darus-1459

Authoring Entity:

Dietrich, Carolin (Universität Stuttgart)

Schuldt, Robin (Universität Stuttgart)

Born, Daniel (Universität Stuttgart)

Solodenko, Helena (Universität Stuttgart)

Schmitz, Guido (Universität Stuttgart)

Kästner, Johannes (Universität Stuttgart)

Grant Number:

358283783 - SFB 1333

Distributor:

DaRUS

Access Authority:

Dietrich, Carolin

Depositor:

Dietrich, Carolin

Date of Deposit:

2021-02-26

Study Scope

Keywords:

Chemistry, Density Functional Theory (DFT), Fragmentation, Field Evaporation, Strong Electric Fields

Topic Classification:

density functional

Abstract:

All primary data files and processed data of the journal article from Kästner group. Turbomole input and output files for all calculations used in the paper, one directory per case.

Methodology and Processing

Sources Statement

Data Access

Notes:

CC BY Waiver

Other Study Description Materials

Related Publications

Citation

Identification Number:

10.1021/acs.jpca.0c06887

Bibliographic Citation:

Carolin A. Dietrich, Robin Schuldt, Daniel Born, Helena Solodenko, Guido Schmitz, and Johannes Kästner "Evaporation and Fragmentation of Organic Molecules in Strong Electric Fields Simulated with DFT" The Journal of Physical Chemistry A, 2020 124 (41), 8633-8642

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