Jan M.L. Martin, Ph.D.

Affiliations: 
1996- Organic Chemistry Weizmann Institute of Science, Rehovot, Israel 
Area:
Computational quantum chemistry
Website:
http://www.compchem.me
Google:
"Jan M.L. Martin Google scholar ZJUBZ1gAAAAJ"
Bio:

Jan Martin, a.k.a. Gershom Martin, was born in Belgium in 1964, and from 1987 until 1999 was an employee of the National Science Foundation of Belgium (NFWO/FNRS), first as a graduate research assistant, then as a senior assistant, then as a "research leader" (onderzoeksleider). In 1996, following a sabbatical at Hebrew University of Jerusalem, he accepted a faculty position at the Weizmann Institute of Science, and has been there ever since except for a sabbatical at Northwestern U. (with George C. Schatz) and a leave of absence 2010-2012 when he was Distinguished University Research Professor at UNT. He is married with one adult daughter.

Mean distance: 8.56
 
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Publications

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Karton A, Martin JML, Gill PMW. (2019) Tribute to Leo Radom. The Journal of Physical Chemistry. A. 123: 10347
Chandar NB, Efremenko I, Silman I, et al. (2019) Molecular dynamics simulations of the interaction of Mouse and Torpedo acetylcholinesterase with covalent inhibitors explain their differential reactivity: Implications for drug design. Chemico-Biological Interactions
Santra G, Sylvetsky N, Martin JML. (2019) Minimally Empirical Double Hybrid Functionals Trained Against the GMTKN55 Database: revDSD-PBEP86-D4, revDOD-PBE-D4, and DOD-SCAN-D4. The Journal of Physical Chemistry. A
Kesharwani MK, Sylvetsky N, Köhn A, et al. (2018) Do CCSD and approximate CCSD-F12 variants converge to the same basis set limits? The case of atomization energies. The Journal of Chemical Physics. 149: 154109
Haviv E, Azaiza-Dabbah D, Carmieli R, et al. (2018) A Thiourea Tether in the Second Coordination Sphere as a Binding Site for CO2 and a Proton Donor Promotes the Electrochemical Reduction of CO2 to CO Catalyzed by a Rhenium Bipyridine Type Complex. Journal of the American Chemical Society
Khenkin AM, Efremenko I, Martin JML, et al. (2018) The kinetics and mechanism of oxidation of reduced phosphovanadomolybdates by molecular oxygen: theory and experiment in concert. Physical Chemistry Chemical Physics : Pccp
Kesharwani MK, Manna D, Sylvetsky N, et al. (2018) The X40x10 Halogen Bonding Benchmark Revisited: Surprising Importance of (N-1)d Subvalence Correlation. The Journal of Physical Chemistry. A
Sylvetsky N, Kesharwani MK, Martin JML. (2017) The aug-cc-pVnZ-F12 basis set family: Correlation consistent basis sets for explicitly correlated benchmark calculations on anions and noncovalent complexes. The Journal of Chemical Physics. 147: 134106
Karton A, Sylvetsky N, Martin JML. (2017) W4-17: A diverse and high-confidence dataset of atomization energies for benchmarking high-level electronic structure methods. Journal of Computational Chemistry
Manna D, Kesharwani MK, Sylvetsky N, et al. (2017) Conventional and explicitly correlated ab initio benchmark study on water clusters: revision of the BEGDB and WATER27 datasets. Journal of Chemical Theory and Computation
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