Jan M. L. Martin

Can DFT methods correctly and efficiently predict the coordination number of copper(I) complexes? A case study

Tamar Ansbacher, Hemant Kumar Srivastava, Jan M. L. Martin, 2010, J. Comput. Chem..

Spin‐component‐scaled double hybrids: An extensive search for the best fifth‐rung functionals blending DFT and perturbation theory

Jan M. L. Martin, Sebastian Kozuch, Jan M. L. Martin, 2013, J. Comput. Chem..

Definitive heat of formation of methylenimine, CH2NH, and of methylenimmonium ion, CH2NH2+, by means of W2 theory

Jan M. L. Martin, Glênisson de Oliveira, Indira K. C. Silwal, 2001, J. Comput. Chem..

Heats of formation of platonic hydrocarbon cages by means of high‐level thermochemical procedures

Peter R. Schreiner, Amir Karton, Jan M. L. Martin, 2016, J. Comput. Chem..

W4‐17: A diverse and high‐confidence dataset of atomization energies for benchmarking high‐level electronic structure methods

Amir Karton, Jan M. L. Martin, Nitai Sylvetsky, 2017, J. Comput. Chem..

Fundamental vibrational frequencies and dominant resonances in methylamine isotopologues by ab initio and density functional theory methods

Jan M. L. Martin, Ilana Bar, Chen Levi, 2008, J. Comput. Chem..