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Lista de obras de Stephan Mohr

3D-printed and CNC milled flow-cells for chemiluminescence detection

artículo científico publicado en 2014

Accurate and efficient linear scaling DFT calculations with universal applicability. ⬇️

artículo científico publicado en 2015

Boron aggregation in the ground states of boron-carbon fullerenes

scholarly article by Stephan Mohr et al published 10 January 2014 in Physical Review B

Chemiluminescence detection flow cells for flow injection analysis and high-performance liquid chromatography

artículo científico publicado en 2012

Complexity Reduction in Density Functional Theory Calculations of Large Systems: System Partitioning and Fragment Embedding

scientific article published on 09 April 2020

Complexity Reduction in Large Quantum Systems: Fragment Identification and Population Analysis via a Local Optimized Minimal Basis

artículo científico publicado en 2017

Daubechies wavelets for linear scaling density functional theory ⬇️

artículo científico publicado en 2014

Efficient Computation of Sparse Matrix Functions for Large-Scale Electronic Structure Calculations: The CheSS Library.

artículo científico publicado en 2017

Efficient moves for global geometry optimization methods and their application to binary systems

artículo científico publicado en 2011

Fragment approach to constrained density functional theory calculations using Daubechies wavelets ⬇️

artículo científico publicado en 2015

Metrics for measuring distances in configuration spaces

scientific article published on 01 November 2013

Minima hopping guided path search: an efficient method for finding complex chemical reaction pathways ⬇️

scientific article published on 01 June 2014

Precision milled flow-cells for chemiluminescence detection.

artículo científico publicado en 2009

Siesta: Recent developments and applications

artículo científico publicado en 2020

The CECAM electronic structure library and the modular software development paradigm

artículo científico publicado en 2020

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