Glenn J Martyna  Glenn J Martyna photo       

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Thomas J. Watson Research Center, Yorktown Heights, NY USA



Imaginary time, shredded propagator method for large-scale GW calculations
G.J. Martyna et al
arXiv, 1707.06752, 2017

High-response piezoelectricity modeled quantitatively near a phase boundary
G.J. Martyna, D.M. Newns et al
Appl. Phys. Lett.110, 022904, 2017

Engineering monolayer poration for rapid exfoliation of microbial membranes
G.J. Martyna et al
Chemical Science8, 1105-1115, 2017


A graphene˙ carbon nanotube hybrid material for photovoltaic applications
G.J. Martyna et al
Carbon102, 74-80, 2016

Openatom: Scalable ab-initio molecular dynamics with diverse capabilities
G.J. Martyna et al
Inter. Conf. High Perf. Comp., , 139-158, 2016

Electronic coarse graining enhances the predictive power of molecular simulation allowing challenges in water physics to be addressed
G.J. Martyna et al
J. Comp. Phys. 326, 222-233, 2016


Phase Diagram of Cuprate High-Temperature Superconductors Described by a Field Theory Based on Anharmonic Oxygen Degrees of Freedom
G.J. Martyna et al
Phys. Rev. Lett.114, 107001, 2015

Signature properties of water: Their molecular electronic origins
G.J. Martyna
PNAS 112, 6341, 2015

Pathway to the PiezoElectronic Transduction Logic Device
G.J. Martyna et al
Nano Lett. 15, 2391, 2015

The piezoelectronic stress transduction switch for very large-scale integration, low voltage sensor computation, and radio frequency applications
G.J. Martyna et al
Appl. Phys. Lett. 107, 07350, 2015


Anisotropic strain in SmSe and SmTe: Implications for electronic transport
MA Kuroda, Z Jiang, M Povolotskyi, G Klimeck, DM Newns, GJ Martyna
Physical Review B 90, 245124, 2014

Optimal Thickness for Charge Transfer in Multilayer Graphene Electrodes
MA Kuroda, J Tersoff, RA Nistor, GJ Martyna
Physical Review Applied 1, 014005, 2014


Nanoscale imaging reveals laterally expanding antimicrobial pores in lipid bilayers
Paulina D Rakowska, Haibo Jiang, Santanu Ray, Alice Pyne, Baptiste Lamarre, Matthew Carr, Peter J Judge, Jascindra Ravi, Ulla IM Gerling, Beate Koksch, Glenn J Martyna, Bart W Hoogenboom, Anthony Watts, Jason Crain, Chris RM Grovenor, Maxim G Ryadnov
Proceedings of the National Academy of Sciences110, 8918, 2013

Electronically coarse-grained model for water
A Jones, F Cipcigan, VP Sokhan, J Crain, GJ Martyna
Physical Review Letters 110(22), 227801, American Physical Society, 2013


High response piezoelectric and piezoresistive materials for fast, low voltage switching: simulation and theory of transduction physics at the nanometer  scale
DM Newns, BG Elmegreen, XH Liu, GJ Martyna
Advanced Materials 24, 3672, 2012


Base-by-base ratcheting of single stranded DNA through a solid-state nanopore
B Luan, H Peng, S Polonsky, S Rossnagel, G Stolovitzky, G Martyna
Physical review letters104, 238103, 2010


Fine-grained parallelization of the Car-Parrinello ab initio molecular dynamics method on the IBM Blue Gene/L supercomputer
E Bohm, A Bhatele, LV Kale, ME Tuckerman, S Kumar, JA Gunnels, GJ Martyna
IBM Journal of Research and Development 52(1/2), 159, 2008


Structural correlations and motifs in liquid water at selected temperatures: Ab initio and empirical model predictions
YA Mantz, B Chen, GJ Martyna
The Journal of Physical Chemistry B 110, 3540, 2006


Long time molecular dynamics for enhanced conformational sampling in biomolecular systems
P Minary, ME Tuckerman, GJ Martyna
Physical review letters93, 150201, 2004


Symplectic quaternion scheme for biophysical molecular dynamics
TF Miller Iii, M Eleftheriou, P Pattnaik, A Ndirango, D Newns, GJ Martyna
Journal of Chemical Physics116, 8649, 2002


Non-Hamiltonian molecular dynamics: Generalizing Hamiltonian phase space principles to non-Hamiltonian systems
ME Tuckerman, Y Liu, G Ciccotti, GJ Martyna
Journal of Chemical Physics115, 1678, 2001


A reciprocal space based method for treating long range interactions in ab initio and force-field-based calculations in clusters
GJ Martyna, ME Tuckerman
Journal of Chemical Physics110, 2810, 1999


Explicit reversible integrators for extended systems dynamics
GJ Martyna, ME Tuckerman, DJ Tobias, ML Klein
Molecular Physics87, 1117, 1996


Constant pressure molecular dynamics algorithms
GJ Martyna, DJ Tobias, ML Klein
Journal of Chemical Physics101, 4177, 1994


Electronic states in metal-ammonia solutions
Z Deng, GJ Martyna, ML Klein
Physical review letters71, 267, 1993


Reversible multiple time scale molecular dynamics
M Tuckerman, BJ Berne, GJ Martyna
Journal of Chemical Physics97, 1990, 1992