J. Tse

发表

Spontaneous assembly of perfectly ordered identical-size nanocluster arrays

Zhenyu Zhang, Q. Xue, J. Jia, 2002, Physical review letters.

First-principles study of electron-phonon coupling in hole- and electron-doped diamonds in the virtual crystal approximation

Yanming Ma, Y. Niu, G. Zou, 2005 .

Unusual Li-Ion Transfer Mechanism in Liquid Electrolytes: A First-Principles Study.

J. Tse, Zhen-Kun Tang, Li‐Min Liu, 2016, The journal of physical chemistry letters.

Density fluctuations in liquid water.

J. Tse, N. English, 2011, Physical review letters.

A Potentially New Li-N Alloy at High Pressure

J. Tse, S. Desgreniers, Jianbao Zhao, 2020 .

Rational design of high-efficiency thermoelectric materials with low band gap conductive polymers

John S. Tse, J. Tse, D. Klug, 2006 .

Superconductive sodalite-like clathrate calcium hydride at high pressures

Hui Wang, Yanming Ma, Toshiaki Iitaka, 2012, Proceedings of the National Academy of Sciences.

Phase stability and broken-symmetry transition of elemental lithium up to 140 GPa.

Roger Rousseau, J. Tse, D. Klug, 2005, Chemphyschem : a European journal of chemical physics and physical chemistry.

Structures of insulating phases of dense lithium.

Yansun Yao, J. Tse, D. Klug, 2009, Physical review letters.

Synthesis and x-ray structure of 2,11-dithia-6,15-dimethyl[3.3]metacyclophane

J. Tse, C. Chan, T. Mak, 1977 .

X-ray Raman of water in the condensed phases

J. Tse, 2008 .

Pressure-induced changes in the electron density distribution in α-Ge near the α-β transition

J. Tse, G. Shen, Jing Liu, 2015 .

Phase transitions in solid C60

J. Tse, D. Klug, Y. P. Handa, 1991 .

Dynamical properties of the structure I clathrate hydrate of xenona)

Michael L. Klein, John S. Tse, Ian R. McDonald, 1983 .

Lattice dynamics of methane and xenon hydrate: Observation of symmetry-avoided crossing by experiment and theory

C. Gutt, J. Tse, D. Klug, 2003 .

Localized oscillators and heat conduction in clathrate hydrates

J. Tse, 1994 .

The lattice dynamics of clathrate hydrates. An incoherent inelastic neutron scattering study

V. F. Sears, J. Tse, Y. P. Handa, 1993 .

The structure of deuterated methane–hydrate

C. Gutt, J. Tse, Mark R. Johnson, 2000 .

The HeI and HeII photoelectron spectra of VOF3 and VOCl3

J. Tse, G. Bancroft, E. Pellach, 1984 .

Bulk sensitive determination of the Fe3+/FeTot-ratio in minerals by Fe L2/3-edge X-ray Raman scattering

J. Tse, R. Gordon, T. Regier, 2016 .

Iron speciation in minerals and glasses probed by $$\hbox{M}_{2/3}$$M2/3-edge X-ray Raman scattering spectroscopy

J. Tse, R. Gordon, S. Huotari, 2014 .

Iron speciation in minerals and glasses probed by M2/3-edge x-ray Raman scattering spectroscopy

J. Tse, R. Gordon, M. Wilke, 2014 .

Pressure induced spin transition revealed by iron M2,3-edge spectroscopy

J. Tse, M. Wilke, N. Hiraoka, 2014 .

Gas-phase nuclear magnetic relaxation in 129Xe revisited

J. Tse, C. Ratcliffe, J. Ripmeester, 2001 .

Crystallographic Studies of Clathrate Hydrates. Part I

L. D. Calvert, J. Dahn, J. Tse, 1986 .

Comments on “Further evidence for the existence of two kinds of H-bonds in ice Ih” by Li et al

J. Tse, D. Klug, 1995 .

First-Principles Methods in the Investigation of the Chemical and Transport Properties of Materials under Extreme Conditions

J. Tse, 2019, Engineering.

Equilibrium Born-Oppenheimer molecular-dynamics exploration of the lattice thermal conductivity of silicon clathrates

Niall J. English, J. Tse, N. English, 2017 .

Luminescent intrazeolitic Si nanoclusters: Size study by Si K and L2,3 x-ray absorption near-edge structure, x-ray photoelectron and photoluminescence spectroscopies

J. Tse, D. Klug, C. Ratcliffe, 1997 .

Polymer‐Passivated Inorganic Cesium Lead Mixed‐Halide Perovskites for Stable and Efficient Solar Cells with High Open‐Circuit Voltage over 1.3 V

Haotong Wei, Hao Zhang, Bai Yang, 2018, Advanced materials.

Crystal and electronic structure of superhard BC 5 : First-principles structural optimizations

J. Tse, D. Klug, Yansun Yao, 2009 .

Electronic structures of the mono- and tricarbonyl of Cu and Ag

J. Tse, 1986 .

Polymerization of Carbon Dioxide: A Chemistry View of Molecular-to-Nonmolecular Phase Transitions

A. Sengupta, J. Tse, C. Yoo, 2012 .

Mixing unmixables: Unexpected formation of Li-Cs alloys at low pressure

Justin J. Tse, J. Tse, Y. Ohishi, 2015, Science Advances.

Crystallography of selected high pressure elemental solids

J. Tse, 2005 .

Superconducting Hydrogen Sulfide.

J. Tse, Yansun Yao, 2018, Chemistry.

Mechanical and Thermal Transport Properties of Clathrate Hydrates

J. Tse, D. Klug, 2022, Clathrate Hydrates.

X ‐ray and Neutron Diffraction and Scattering of Clathrate Hydrates

J. Tse, D. Klug, S. Takeya, 2022, Clathrate Hydrates.

Stability of rocksalt phase of zinc oxide under strong compression: Synchrotron x-ray diffraction experiments and first-principles calculation studies

H. Mao, J. Tse, Haozhe Liu, 2006 .

Electronic structure of the ground and low-lying states of the dimer and trimer of aluminum

J. Tse, 1988 .

High-pressure bct to fcc structural transformation in Ga

Zhi-Qiang Li, J. Tse, 2000 .

Persistent Octahedral Coordination in Amorphous GeO2 Up to 100 GPa by Kβ′′ X-Ray Emission Spectroscopy

J. Tse, W. Morgenroth, M. Wilke, 2019, Physical Review X.

Formation and structure of a dense octahedral glass.

H. Mao, J. Tse, R. Hemley, 2004, Physical review letters.

Carbon‐Quantum‐Dots‐Loaded Ruthenium Nanoparticles as an Efficient Electrocatalyst for Hydrogen Production in Alkaline Media

Xiaolei Feng, Kaifeng Wu, Bai Yang, 2018, Advanced materials.

A comparison of valence level photoelectron cross sections for SF6, SeF6 and “F6” from 21 eV to 100 eV photon energy

J. Tse, B. Yates, G. Bancroft, 1989 .

Stable methane hydrate above 2 GPa and the source of Titan's atmospheric methane

J. Loveday, J. Tse, D. Klug, 2001, Nature.

In situ detection of misfit dislocations by light scattering

C. Lavoie, R. Goldman, K. Kavanagh, 1997 .

First-principles study of the mechanisms for the pressure-induced phase transitions in zinc-blende CuBr and CuI

Yanming Ma, J. Tse, D. Klug, 2004 .

Pressure-induced phonon instabilities in copper chloride

Yanming Ma, J. Tse, D. Klug, 2003 .

Structures and superconducting properties of the high-pressure IV and V phases of calcium from first principles

Jian Sun, John S. Tse, Yansun Yao, 2008 .

Electron-phonon coupling in the high-pressure hcp phase of xenon: A first-principles study

J. Tse, Yansun Yao, 2007 .

Mechanisms for pressure-induced crystal-crystal transition, amorphization, and devitrification of SnI4.

J. Tse, W. Bi, E. Alp, 2015, The Journal of chemical physics.

Hydrogen-Doped Polymeric Carbon Monoxide at High Pressure

J. Tse, Eun Jeong Kim, Sung Keun Lee, 2017 .

The longitudinal‐optic–tranverse‐optic mode splitting in ice Ih

J. Tse, D. Klug, E. Whalley, 1991 .

In situ X-ray diffraction study of chrysotile at high P–T conditions: transformation to the 3.65 Å phase

J. Tse, S. Goryainov, M. Molokeev, 2021, Physics and Chemistry of Minerals.

Compression behavior of dense H2−He mixtures up to 160 GPa

J. Tse, Y. Ohishi, H. Liermann, 2020, Physical Review B.

Pressure amorphized ices--an atomistic perspective.

J. Tse, D. Klug, 2012, Physical chemistry chemical physics : PCCP.

Thermal conductivity in amorphous ices from molecular dynamics

J. Tse, N. English, R. Gallagher, 2010 .

Coupling of localized guest vibrations with the lattice modes in clathrate hydrates

F. Trouw, J. Tse, W. Press, 2001 .

Origin of glassy crystalline behavior in the thermal properties of clathrate hydrates: a thermal conductivity study of tetrahydrofuran hydrate

M. White, J. Tse, 1988 .

Polymer-Passivated Inorganic Cesium Lead Halide Perovskites for High-Voltage and High-Efficiency Solar Cells

Haotong Wei, Hao Zhang, Bai Yang, 2018 .

Tunable Excitonic Processes at Organic Heterojunctions

J. Tse, Zhenghong Lu, Deng-ke Wang, 2016, Advanced materials.

Alloying effects on elastic properties of TiN-based nitrides

J. Rodgers, J. Tse, L. Zhao, 2003 .

Structural phase transition in CaH2 at high pressures

Jesse S. Smith, J. Tse, D. Klug, 2007 .

Synthesis and Thermoelectric Properties of Polycarbazole, Polyindolocarbazole, and Polydiindolocarbazole Derivatives

M. Leclerc, J. Tse, D. Klug, 2007 .

First-principles investigation on the geometry and electronic structure of the three-dimensional cuboidal C60 polymer

T. Iitaka, J. Tse, Jianjun Yang, 2007 .

Pressure-stabilized superconductive yttrium hydrides

Yanming Ma, John S. Tse, Yinwei Li, 2015, Scientific Reports.

Usage Report for Fiscal Year 2019 Project Title : Prediction of Crystal Structure and Properties Name :

Yanming Ma, J. Tse, Zhi Li, 2014 .

Hardness of nanocrystalline diamonds

J. Tse, D. Klug, Faming Gao, 2006 .

Crystal Structures of CaB3N3 at High Pressures.

J. Tse, Li Zhu, Hanyu Liu, 2017, Inorganic chemistry.

Dynamics of elemental lithium at megabar pressures

T. Iitaka, J. Tse, D. Klug, 2006 .

Bonding, structures, and band gap closure of hydrogen at high pressures

J. Tse, Hui Wang, V. Struzhkin, 2012, 1209.3895.

Core effects on the energetics of solid Li at high pressure

J. Tse, D. Klug, Yansun Yao, 2009 .

Prediction of Host-Guest Na-Fe Intermetallics at High Pressures.

Hui Wang, Yanming Ma, Hanyu Liu, 2016, Inorganic chemistry.

Theory-directed discovery of high-temperature superconductivity in clathrate hydrides at high pressure

J. Tse, R. Hemley, Hanyu Liu, 2022, Innovation.

Unzipping of Graphene by Fluorination

J. Tse, Min Wu, Jianzhong Jiang, 2010 .

Novel modulated structure of superconducting hydrogen sulfide

A. Majumdar, J. Tse, Y. Yao, 2017 .

New-phase retention in colloidal core/shell nanocrystals via pressure-modulated phase engineering†

J. Tse, Siyu Lu, Yixuan Wang, 2021, Chemical science.

Turning on Zn 4s Electrons in a N2-Zn-B2 Configuration to Stimulate Remarkable ORR Performance.

Jiujun Zhang, J. Tse, Yufeng Zhao, 2020, Angewandte Chemie.

Towards an ultra-long lifespan Li-CO2: electron structure and charge transfer pathway regulation on hierarchical architecture

J. Tse, Meng Yang, Carlos Segovia Fernández, 2022, Chemical Engineering Journal.

Stability and potential energy surface of the three low lying electronic states of Al3

J. Tse, 1990 .

Structure of oxygen clathrate hydrate by neutron powder diffraction

J. Tse, C. Ratcliffe, Y. P. Handa, 1986 .

Laboratory analysis of a naturally occurring gas hydrate from sediment of the Gulf of Mexico

J. Tse, C. Ratcliffe, J. Ripmeester, 1986 .

THE THREE ISOMERS OF PROTONATED ETHANE, C2H7+

J. Tse, C. McCague, Zhifeng Liu, 1998 .

Quantum rotations in natural methane-clathrates from the Pacific sea-floor

C. Gutt, J. Tse, J. Greinert, 1999 .

THERMAL EXPANSION OF THE CLATHRATE HYDRATES OF ETHYLENE OXIDE AND TETRAHYDROFURAN

J. Tse, 1987 .

Insulator-metal transition of highly compressed carbon disulfide

J. Tse, C. Yoo, Minseob Kim, 2011 .

Robust Diffusive Proton Motions in Phase IV of Solid Hydrogen

Yanming Ma, J. Tse, Hanyu Liu, 2013, 1311.7086.

Structures and Stability of Iron Halides at the Earth’s Mantle and Core Pressures: Implications for the Missing Halogen Paradox

T. Iitaka, J. Tse, Hui Wang, 2018, ACS Earth and Space Chemistry.

Electronic and phonon instabilities in face-centered-cubic alkali metals under pressure studied using ab initio calculations

Yanming Ma, G. Zou, T. Cui, 2007 .

Enhanced figure of merit in Mg2Si0.877Ge0.1Bi0.023/multi wall carbon nanotube nanocomposites

J. Tse, M. Bugnet, G. Botton, 2015 .

Bonding in the epsilon-phase of high pressure oxygen

J. Tse, D. Klug, S. Desgreniers, 2008 .

Alloying effect on atomic strengthening of binary Ir solid solutions: a first-principles study

J. Tse, L. Zhao, Kuiying Chen, 2004 .

Elastic properties of potential superhard phases of RuO 2

Zhi-Qiang Li, J. Tse, D. Klug, 2000 .

X-ray diffraction and theoretical studies of the high-pressure structures and phase transitions in magnesium fluoride

Zhi-Qiang Li, J. Tse, D. Klug, 2001 .

Magma properties at deep Earth’s conditions from electronic structure of silica

J. Tse, M. Wilke, S. Petitgirard, 2019, Geochemical Perspectives Letters.

Magma properties at Earth ' s lower mantle conditions inferred from electronic structure and coordination in silica

J. Tse, M. Wilke, S. Petitgirard, 2019 .

Rational design of the first and second coordination spheres for copper single-atom catalyst to boost highly efficient oxygen reduction

J. Tse, M. Xia, Yan Li, 2022, Applied Surface Science.

The electronic mechanism of the γ/γ′ interface strength of Ir-based alloys

J. Tse, L. Zhao, Kuiying Chen, 2002 .

Instability of CaLi2 at high pressure: Theoretical prediction and experimental results

J. S. Smith, J. Tse, S. Desgreniers, 2009 .

Anomalous compressive behavior in CeO2 nanocubes under high pressure

H. Mao, T. Kikegawa, J. Tse, 2008 .

Sulfur embrittlement on γ/γ′ interface of Ni-base single crystal superalloys

J. Tse, L. Zhao, Kuiying Chen, 2003 .

Atomic mechanism of the Re and Ru strengthening effect on the γ-γ′ interface of Ni-based single-crystal superalloys: A first-principles study

J. Tse, L. Zhao, Kuiying Chen, 2003 .

A bridge structure for the Ag ⋯ SiO adduct

J. Tse, 1990 .

Electronic structure and ESCA shake-up of the UF6 molecule

J. Tse, J. Esquivel, S. Larsson, 1984 .

Stability, elastic and electronic properties of palladium nitride

J. Tse, J. Jiang, W. Chen, 2010, Journal of physics. Condensed matter : an Institute of Physics journal.

Highly soluble poly(2,7-carbazolenevinylene) for thermoelectrical applications : From theory to experiment

M. Leclerc, J. Tse, D. Klug, 2005 .

New Conjugated Polymers Derived from Carbazole as Thermoelectric Materials

M. Leclerc, J. Tse, D. Klug, 2005 .

Heavy atom ferromagnets under pressure: structural changes and the magnetic response.

J. Tse, S. Desgreniers, M. Mito, 2009, Journal of the American Chemical Society.

Reversible amorphization and structural memory effect in clathrasil dodecasil-3c

J. Tse, D. Klug, 1995 .

Structural Memory in Pressure-Amorphized AlPO4

J. Tse, D. Klug, 1992, Science.

On the bonding and structure of ethylene-BrCl adducts

J. Tse, M. Kolbuszewski, Marcin Kolbuszewski, 1995 .

Electronic structure of carbon dioxide under pressure and insights into the molecular-to-nonmolecular transition

J. Tse, I. Jarrige, N. Hiraoka, 2013, Proceedings of the National Academy of Sciences.

Refinement of the crystal structure of polyethylene terephthalate

J. Tse, T. Mak, 1975 .

Core level ligand field splittings in photoelectron spectra

R. P. Gupta, J. Tse, G. Bancroft, 1980, Philosophical Transactions of the Royal Society of London. Series A, Mathematical and Physical Sciences.

High-pressure phase transition observed in barium hydride

Jesse S. Smith, J. Tse, D. Klug, 2007 .

Single Atom Ruthenium‐Doped CoP/CDs Nanosheets via Splicing of Carbon‐Dots for Robust Hydrogen Production

J. Tse, Siyu Lu, Bai Yang, 2021, Angewandte Chemie.

Single atom Ru doped CoP/CDs Nanosheets via Splicing of Carbon-Dots for Robust Hydrogen Production.

Z. Tang, Bai Yang, J. Tse, 2021, Angewandte Chemie.

Crystal, spin, and electronic structure of the superconductor LiFeAs

J. Tse, C. Jin, Zhi Li, 2009 .

Structural systematics in the clathrate hydrates under pressure

J. Loveday, J. Tse, D. Klug, 2003 .

Transition from cage clathrate to filled ice: the structure of methane hydrate III.

J. Loveday, J. Tse, D. Klug, 2001, Physical review letters.

Transition from Cage Clathrate to Filled Ice

J. Loveday, J. Tse, D. Klug, 2001 .

Molecular Perspectives on Structure and Dynamics in Clathrate Hydrates

J. Tse, D. Klug, C. Ratcliffe, 1994 .

NMR of 129Xe Trapped in Clathrates and Some Other Solids.

J. Tse, C. Ratcliffe, J. Ripmeester, 1989 .

The nuclear magnetic resonance of 129Xe trapped in clathrates and some other solids

J. Tse, C. Ratcliffe, J. Ripmeester, 1988 .

Computer simulation studies of the structure I clathrate hydrates of methane, tetrafluoromethane, cyclopropane, and ethylene oxide

Michael L. Klein, John S. Tse, Ian R. McDonald, 1984 .

The isotope effect and orientational potentials of methane molecules in gas hydrates

C. Gutt, J. Tse, W. Press, 2001 .

Motion of CH4 molecules in D2O clathrate from incoherent inelastic neutron scattering

V. F. Sears, J. Tse, C. Ratcliffe, 1992 .

Pressure‐induced phase transitions in clathrate hydrates

J. Tse, D. Klug, Y. P. Handa, 1991 .

Molecular dynamics studies of ice Ic and the structure I clathrate hydrate of methane

I. R. Mcdonald, M. Klein, J. Tse, 1983 .

Magnetic behavior of Fe(Se,Te) systems: First-principles calculations

J. Tse, Hai-Qing Lin, Hongliang Shi, 2011 .

Compton scattering of elemental silicon at high pressure

J. Tse, D. Klug, D. Jiang, 2005 .

ESR spectrum of Cu5, a trigonal bipyramidal copper cluster☆

J. Tse, B. Mile, J. Howard, 1983 .

High-Pressure Nonequilibrium Dynamics on Second-to-Microsecond Time Scales: Application of Time-Resolved X-ray Diffraction and Dynamic Compression in Ice.

J. Tse, Chuanlong Lin, 2021, The journal of physical chemistry letters.

Electron density topology of cubic structure I Xe clathrate hydrate at high pressure.

J. Tse, S. Desgreniers, R. Flacau, 2008, The Journal of chemical physics.

The structure of methane hydrate under geological conditions a combined Rietveld and maximum entropy analysis.

C. Gutt, J. Tse, D. Klug, 2004, The Journal of chemical physics.

Superconductivity in lithium under high pressure investigated with density functional and Eliashberg theory

Yansun Yao, J. S. Tse, J. Tse, 2009 .

Stability and properties of liquid CO2 at high pressure and high temperature: Implications for electrical conductivities in Earth's lower mantle

J. Tse, Min Wu, Yuanming Pan, 2015 .

Characterization of the intermediates formed in the reaction of Al atoms with H2O, H2S and H2Se by EPR spectroscopy

J. Tse, J. Howard, H. Joly, 1994 .

An MP2 and MCSCF/CI study of the aluminum-acetylene adducts

J. Tse, 1990 .

The electron spin resonance spectrum of Al[C2H4] in hydrocarbon matrices

J. Tse, H. Morris, B. Mile, 1987 .

An ESR Study of the Reaction of Aluminum Atoms with Buta-1,3-diene: Cheleotropic Cycloaddition and Substituted Allyl Formation.

J. Tse, B. Mile, J. Howard, 1985 .

Electroncytochemical and biochemical demonstration of guanylate cyclase activity in the pancreatic islet

J. Tse, B. Lin, Y. Shibayama, 1978, Histochemistry.

Transformation of ice VIII to amorphous ice by ‘‘melting’’ at low temperature

J. Tse, D. Klug, Y. P. Handa, 1989 .

SOME STRUCTURAL STUDIES OF CLATHRATE HYDRATES

J. Tse, C. Ratcliffe, J. Ripmeester, 1987 .

The ability of small molecules to form clathrate hydrates of structure II

J. Tse, C. Ratcliffe, D. Davidson, 1984, Nature.

The electronic structure of trifluoronitrosomethane

J. Tse, J. Goddard, J. D. Goddard, 1986 .

Ab initio quantum-mechanical calculations of magnetic shielding constants of 13C, 15N and 19F in CF 3X(X = H,F,CN,CI,NO)

J. Tse, S. Garg, 1982 .

Theoretical studies of magnetic shielding in HCN and (HCN)2

J. Tse, 1982 .

Experimental and theoretical shakeup studies. IV. Main group Me2M (M=Zn,Cd,Hg) compounds

J. Tse, D. Creber, G. Bancroft, 1981 .

Pancakes under Pressure: A Case Study on Isostructural Dithia- and Diselenadiazolyl Radical Dimers.

J. Tse, R. Secco, R. Bauer, 2019, Inorganic chemistry.

Melting and High P-T Transitions of Hydrogen up to 300 GPa.

J. Tse, R. Hemley, Hanyu Liu, 2017, Physical review letters.

Theoretical design of two-dimensional AMInP2X3Y3 (AM = Li, Na, K; X/Y = S, Se, Te) monolayers for highly efficient excitonic solar cells

J. Tse, Yu Xie, Yanming Ma, 2023, Materials Advances.

Uptake and speciation of uranium in synthetic gypsum (CaSO4•2H2O): Applications to radioactive mine tailings.

J. Tse, Patrick Zhang, N. Chen, 2018, Journal of environmental radioactivity.

VARIABLE-ENERGY PHOTOELECTRON SPECTROSCOPY OF CPM(CO)3 (M = MN, RE) AND CPFE(CO)2I

J. Tse, G. Bancroft, K. Tan, 1996 .

The low frequency vibrations in clathrate hydrates

J. Tse, V. Murashov, V. Belosludov, 1997 .

Phonons on GaN(110)

G. P. Srivastava, J. Tse, R. Miotto, 2002 .

Slow compression of crystalline ice at low temperature

J. Tse, T. Hattori, K. Komatsu, 2020, Nature.

A twist in the tale of the structure of ice

J. Tse, 2019, Nature.

Reversible pressure-induced crystal-amorphous structural transformation in ice Ih

Niall J. English, J. Tse, N. English, 2014 .

Investigation of the intermediate- and high-density forms of amorphous ice by molecular dynamics calculations and diffraction experiments

J. Tse, D. Klug, C. Benmore, 2005 .

Hysteretic spin crossover between a bisdithiazolyl radical and its hypervalent σ-dimer.

L. Downie, J. Tse, R. Secco, 2010, Journal of the American Chemical Society.

Theoretical and experimental shake-up studies on the xenon core level ESCA of xenon difluoride

J. Tse, G. Bancroft, D. J. Bristow, 1979 .

Electronic structure of square-planar cis-bis(trifluoromethyl)platinum(II) complexes from UV photoelectron spectra and SCF-MS-X.alpha. calculations

J. Tse, R. Puddephatt, G. Bancroft, 1990 .

The identification of Fe2+ in the M4 site of calcic amphiboles: discussion

J. Tse, L. P. Alonrocn, eNo G. M. BeNcnopr, 1982 .

Electron Density Topology of Crystalline Solids at High Pressure

J. Tse, E. Boldyreva, 2011 .

Complexes of tris(2-pyridyl)alkyl)amines with lithium and sodium salts

J. Tse, S. Brownstein, C. Bensimon, 1994 .

Electron paramagnetic resonance studies of radical pairs [M(CO)–5]2(M = Cr, Mo, W) trapped in single crystals of PPh+4HM(CO)–5

Antony J. Williams, J. Tse, R. Hynes, 1991 .

The Power of Packing: Metallization of an Organic Semiconductor.

J. Tse, A. Assoud, Robert C. M. Claridge, 2017, Journal of the American Chemical Society.

Benzoquinone-Bridged Heterocyclic Zwitterions as Building Blocks for Molecular Semiconductors and Metals.

J. Tse, A. Assoud, R. Secco, 2018, Inorganic chemistry.

Pressure induced phase transitions and metallization of a neutral radical conductor.

J. Tse, Y. Ohishi, R. Secco, 2014, Journal of the American Chemical Society.

Ab initio molecular dynamics with density functional theory.

J. Tse, John S Tse, 2003, Annual review of physical chemistry.

Polycarbon Ligand Chemistry: Electronic Interactions between a Mononuclear Ruthenium Fragment and a Cobalt−Carbon Cluster Core

J. Tse, R. Rousseau, G. Enright, 1999 .

Structures of the metallic and superconducting high pressure phases of solid CS2

Niloofar Zarifi, Hanyu Liu, John S. Tse, 2015, Scientific Reports.

Pushing TC to 27.5 K in a heavy atom radical ferromagnet.

J. Tse, A. Assoud, N. Hirao, 2016, Chemical communications.

From magnets to metals: the response of tetragonal bisdiselenazolyl radicals to pressure.

L. Downie, J. Tse, Y. Ohishi, 2011, Journal of the American Chemical Society.

Electronic structure of cis-dimethylplatinum(II) complexes from UV photoelectron spectra and SCF-MS-X.alpha. calculations

L. Dignard-Bailey, J. Tse, R. Puddephatt, 1990 .

High resolution gas phase photoabsorption spectra of SiCl4 and Si(CH3)4 at the silicon l edges: characterization and assignment of resonances

J. Bozek, J. Tse, G. Bancroft, 1987 .

Ab Initio Studies on Al+(H2O)n, HAlOH+(H2O)n-1, and the Size-Dependent H2 Elimination Reaction

John S. Tse, Zhi-Feng Liu, J. Tse, 2002 .

Pressure-induced hydrogen-dominant metallic state in aluminum hydride.

M. Eremets, J. Tse, M. Hanfland, 2008, Physical review letters.

Matrix isolation EPR study of the reaction of Ag atoms with PN, SiS, and GeO

J. Tse, J. Howard, P. Timms, 1992 .

High-density strontium hydride: An experimental and theoretical study

Jesse S. Smith, J. Tse, D. Klug, 2009 .

Role of the gold 5d orbitals in bonding: photoelectron spectra of [AuMe(PMe3)]

J. Tse, R. Puddephatt, G. Bancroft, 1982 .

13C NMR characterization of acetonitrile-hydroquinone clathrate

J. Tse, J. Ripmeester, D. Davidson, 1982 .

EPR spectroscopic study of the reaction of Al and Ga atoms with CO2 and CS2 in a rotating cryostat

J. Tse, C. McCague, J. Howard, 1995 .

Graphene nanostructures as tunable storage media for molecular hydrogen.

J. Tse, G. Seifert, S. Patchkovskii, 2005, Proceedings of the National Academy of Sciences of the United States of America.

High resolution gas phase photoabsorption spectra and multiple-scattering Xα study of PX3 (X=H, CH3, CF3) compounds at the P L2,3 edge

J. Tse, G. Bancroft, K. Tan, 1990 .

A variable energy photoelectron study of the valence levels and I 4d core levels of CF3I

J. Tse, B. Yates, G. Bancroft, 1986 .

Shape resonances above the Si 2p threshold in SiF4

J. Tse, B. Yates, S. Aksela, 1986 .

Piezochromic Carbon Dots with Two-photon Fluorescence.

Bai Yang, Xue Yong, Mingxing Jin, 2017, Angewandte Chemie.

Superconducting Binary Hydrides: Theoretical Predictions and Experimental Progresses

J. Tse, V. Struzhkin, Lin Wang, 2021, Materials Today Physics.

Fine Tuning the Performance of Multiorbital Radical Conductors by Substituent Effects.

J. Tse, A. Assoud, Robert C. M. Claridge, 2017, Journal of the American Chemical Society.

Theoretical calculation of shakeup intensities using Xα–SW wave functions

J. Tse, G. Loubriel, 1981 .

A chemical perspective on high pressure crystal structures and properties

J. Tse, 2019, National science review.

Formation of Gas Hydrate under Curious Conditions as Probed by 129Xe NMR.

J. Tse, C. Ratcliffe, J. Ripmeester, 2002 .

Dark channel fluorescence observations result from concentration effects rather than solvent-solute charge transfer.

J. Tse, T. Regier, D. Hawthorn, 2012, Nature chemistry.

Effect of pressure on the iron arsenide superconductor LixFeAs (x=0.8,1.0,1.1)

J. Tse, L. X. Yang, Xiaoyan Wang, 2009 .

Crystal structure and infrared spectra of an inclusion compound of cyclotriveratrylene and water

J. Tse, D. Klug, J. Ripmeester, 1985 .

Room-temperature and low-temperature structure of triphenyltin chloride

J. Tse, E. Gabe, F. Lee, 1986 .

Onset of anharmonicity and thermal conductivity in SnSe

J. Tse, N. English, Xue Yong, 2021, Physical Review B.

The metallic state in neutral radical conductors: dimensionality, pressure and multiple orbital effects.

J. Tse, Y. Ohishi, H. Yamaguchi, 2015, Journal of the American Chemical Society.

Heat, pressure and light-induced interconversion of bisdithiazolyl radicals and dimers.

J. Tse, M. Shatruk, R. Secco, 2014, Journal of the American Chemical Society.

Crossing the insulator-to-metal barrier with a thiazyl radical conductor.

J. Tse, Zhenxian Liu, R. Secco, 2012, Journal of the American Chemical Society.

Isostructural bis-1,2,3-thiaselenazolyl dimers.

J. Tse, Xueyang Yu, R. Secco, 2009, Inorganic chemistry.

Metallization of a hypervalent radical dimer: molecular and band perspectives.

J. Tse, Y. Ohishi, Xueyang Yu, 2010, Journal of the American Chemical Society.

A Pressure Induced Structural Dichotomy in Isostructural Bis-1,2,3-thiaselenazolyl Radical Dimers

J. Tse, Y. Ohishi, R. Secco, 2012 .

Multiple-scattering-Xα studies of the L2,3 near edge photoabsorption spectra of H2S, HCl and Cl2, and on the intensity variation in the L2,3 near edge spectra of XHn, X=Si, P, S, Cl and n=4, 3, 2, 1

J. Tse, G. Bancroft, Zhongqiang Yang, 1995 .

Thermally induced phase transformations in the clathrasil Dodecasil-3C: The role of guest molecules

J. Tse, J. Ripmeester, Y. P. Handa, 1993 .

Thermally induced phase transitions in the clathrasil dodecasil-3C (zeolite ZSM-39)

J. Tse, J. Ripmeester, Y. P. Handa, 1988 .

Vibrational dynamics in H+-substituted forsterite: A first-principles molecular dynamics study

J. Tse, D. M. Shaw, 2007 .

Electronic structures of greigite (Fe3S4): A hybrid functional study and prediction for a Verwey transition

J. Tse, Min Wu, Yuanming Pan, 2016, Scientific Reports.

The role of non-deformable units in pressure-induced reversible amorphization of clathrasils

J. Tse, D. Klug, J. Ripmeester, 1994, Nature.

Thermal expansion of clathrasil pyrolidene dodecasil-3C

J. Tse, J. Ripmeester, M. Zakrzewski, 1993 .

A new clathrate hydrate structure

John S. Tse, Christopher I. Ratcliffe, John A. Ripmeester, 1987, Nature.

Thermal expansion of structure-H clathrate hydrates

J. Tse, 1990 .

Pressure-induced internal redox reaction of Cs2[PdI4].I2, Cs2[PdBr4].I2, and Cs2[PdCl4].I2.

J. Tse, M. Armbrüster, U. Schwarz, 2006, Inorganic chemistry.

High-resolution HeI and HeII photoelectron spectra of the Zn 3d and Cd 4d orbitals in the zinc and cadmium dihalides: Ligand field splittings and intensity variations

J. Tse, G. Bancroft, D. J. Bristow, 1983 .

Lattice vibrations and infrared absorption of ice Ih

M. Klein, J. Tse, M. Marchi, 1986 .

The structure and dynamics of silica polymorphs using a two-body effective potential model

J. Tse, D. Klug, 1991 .

15N NMR chemical shifts in solid NH+4 salts

J. Tse, C. Ratcliffe, J. Ripmeester, 1983 .

The pressure-induced phase transition of the alpha -cristobalite form of GaPO4

J. Tse, L. Dubrovinsky, V. Murashov, 1995 .

Rietveld refinement using synchrotron powder diffraction data for curcumin, C21H20O6, and comparison with density functional theory

J. Tse, J. Kaduk, J. Reid, 2014, Powder Diffraction.

High resolution core and valence band XPS spectra of non-conductor pyroxenes

J. Tse, H. Nesbitt, G. Bancroft, 2006 .

Experimental and theoretical shakeup studies. III. The 1s shakeup in CH4, NH3, and H2O

J. Tse, D. Creber, G. Bancroft, 1980 .

Origin of pressure-induced crystallization of Ce75Al25 metallic glass

J. Tse, Min Wu, S.Y. Wang, 2015, Nature Communications.

A SCF Xα SW study of the shake-up in TiCl4

J. Tse, 1981 .

Mechanical instability of α-quartz: A molecular dynamics study

J. Tse, D. Klug, 1991 .

High-pressure four-coordinated structure of SiO2

J. Tse, D. Klug, M. Bernasconi, 1997 .

First-principles studies of pressure-induced phase transitions in SiO2

J. Tse, D. Klug, M. Geshi, 2002 .

Theoretical study of new superhard materials : B4C3

J. Tse, D. Klug, F. Gao, 2007 .

Sb- and Bi-doped Mg2Si: location of the dopants, micro- and nanostructures, electronic structures and thermoelectric properties.

J. Tse, G. Botton, Zhenxian Liu, 2014, Dalton transactions.

Electronic and magnetic structure of neutral radical FBBO

D. Graf, J. Tse, H. Yamaguchi, 2014 .

Pressure-induced phase transition and electrical properties of thermoelectric Al-doped Mg2Si

J. Tse, R. Gordon, Zhenxian Liu, 2015 .

Stabilization of H3 + in the high pressure crystalline structure of HnCl (n = 2–7)

T. Iitaka, Yanming Ma, J. Tse, 2014, Chemical science.

Photoelectron study of the valence levels of CF4 and SiF4 from 20 to 100 eV

J. Tse, B. Yates, G. Bancroft, 1985 .

Ligand-Field Splittings on Core Levels of Main Group Compounds and Metal Surfaces from Photoelectron Spectra

J. Tse, G. Bancroft, 1986 .

Resonant enhancement in the valence orbital photoionization cross sections of xenon difluoride

J. Tse, 1988 .

Dynamics of Carbonium Ions Solvated by Molecular Hydrogen: CH5+(H2)n (n = 1, 2, 3)

J. Tse, Y. Lee, A. Suits, 1995, Science.

A variable energy photoelectron study of the valence and Hg 5d levels of Hg(CH3)2

J. Tse, B. Yates, G. Bancroft, 1987 .

Ab initio molecular dynamics study on the thermal dissociation of acetic acid

J. Tse, C. Siu, Zhifeng Liu, 1999 .

Photoelectron study of the valence level cross sections of XeF2 from 21 to 50 eV photon energy

J. Tse, B. Yates, G. Bancroft, 1986 .

Layered polysilane: thermolysis and photoluminescence

J. Tse, D. Klug, K. F. Preston, 1998 .

Crystal Structures and Chemical Bonding of Magnesium Carbide at High Pressure

J. Tse, Hanyu Liu, J. Hao, 2015 .

High-pressure crystal structures of TaAs from first-principles calculations

J. Tse, Hanyu Liu, Miao Zhang, 2016 .

Electronic character of interdiffusion of metals in nickel

J. Tse, L. Zhao, K. Chen, 2005 .

Valence band x-ray emission spectra of compressed germanium.

Yanming Ma, H. Mao, J. Tse, 2006, Physical review letters.

Superconductivity in FeH 5

A. Majumdar, J. Tse, Min Wu, 2017 .

Electron-phonon coupling in high-pressure Nb

Yanming Ma, R. Ahuja, Zhi-Qiang Li, 2004 .

STRUCTURE AND DYNAMICS OF LIQUID SULPHUR

J. Tse, D. Klug, 1999 .

Collapsing cristobalitelike structures in silica analogues at high pressure.

J. Tse, D. Klug, J. Haines, 2003, Physical review letters.

Electronic and crystal structures of osmium under high pressure

Yanming Ma, G. Zou, T. Cui, 2005 .

Thermal Conductivity of High-Temperature Phases of Cu2S from Ab Initio Molecular Dynamics: Advent of Lattice-Site Hopping

J. Tse, N. English, Xue Yong, 2020 .

Density power law and structures of metallic glasses

J. Tse, Lin Zhang, Min Wu, 2017 .

A first-principles survey of γ/γ′ interface strengthening by alloying elements in single crystal Ni–base superalloys

J. Tse, L. Zhao, Kuiying Chen, 2004 .

Ab initio study of elastic properties of Ir and Ir3X compounds

J. Tse, L. Zhao, Kuiying Chen, 2003 .

The Ba 4d–4f giant dipole resonance in complex Ba/Si compounds

J. Tse, R. Gordon, S. Yamanaka, 2014 .

The barium giant dipole resonance in barite: a study of soft X-ray absorption edges using hard X-rays

J. Tse, S. Huotari, C. Sternemann, 2008 .

X-ray Raman scattering at theLedges of elemental Na, Si, and theNedge of Ba inBa8Si46

J. Tse, G. Vankó, R. Secco, 2005 .

Band Gaps and Effective Oscillator Models for Solid Hydrogen and H$_2$O Ice at High Pressure

J. Tse, R. Hemley, W. Yim, 2017 .

Two-dimensional boron-nitrogen-carbon monolayers with tunable direct band gaps.

Yanchao Wang, Yanming Ma, J. Tse, 2015, Nanoscale.

Oxygen Packing Fraction and the Structure of Silicon and Germanium Oxide Glasses.

J. Tse, Xian-Wu Du, 2017, The journal of physical chemistry. B.

New Raman measurements for H2O ice VII in the range of 300 cm-1 to 4000 cm-1 at pressures up to 120 GPa.

J. Tse, C. Zha, W. Bassett, 2016, The Journal of chemical physics.

Silicon clathrates as anode materials for lithium ion batteries

J. Tse, Jianjun Yang, 2013 .

Large bandgap of pressurized trilayer graphene

H. Mao, J. Tse, Junqiao Wu, 2019, Proceedings of the National Academy of Sciences.

Lithiation MAX derivative electrodes with low overpotential and long-term cyclability in a wide-temperature range

J. Tse, D. Liu, Meng Yang, 2022, Energy Storage Materials.

NMR chemical shifts of dilute 1H in inorganic solids

J. Tse, C. Ratcliffe, J. Ripmeester, 1985 .

Engineering the synergistic effect of carbon dots‐stabilized atomic and subnanometric ruthenium as highly efficient electrocatalysts for robust hydrogen evolution

Qinghua Zhang, J. Tse, Siyu Lu, 2021, SmartMat.

Irreversibility of the pressure-induced phase transition of quartz and the relation between three hypothetical post-quartz phases

J. Tse, M. Müser, P. Schöffel, 2004 .

Characterization of leached layers on olivine and pyroxenes using high-resolution XPS and density functional calculations

J. Tse, H. Nesbitt, G. Bancroft, 2008 .

Formation and properties of water from quartz and hydrogen at high pressure and temperature

Niall J. English, J. Tse, Z. Futera, 2017 .

Preparation and Mössbauer spectra of organotin(IV) compounds containing the CH3(C6H5)Sn(IV) moiety

J. Tse, T. Sham, G. Bancroft, 1977 .

High Resolution Gas Phase Photoelectron Spectra of Core d Levels Using He II Radiation

J. Tse, D. Creber, G. Bancroft, 1977 .

Theoretical studies on the thermopower of semiconductors and low-band-gap crystalline polymers

J. Tse, D. Klug, S. Patchkovskii, 2005 .

X-ray Raman spectroscopic study of water in the condensed phases.

J. Tse, D. Klug, S. Patchkovskii, 2008, Physical review letters.

Broadening of the Ba 5p32 level in the photoelectron spectra of the gaseous barium halides

J. Tse, G. Bancroft, 1980 .

High resolution core level photoelectron spectroscopy using He II radiation: electric field gradient splittings in group IIB and group III compounds

J. Tse, G. Bancroft, L. Coatsworth, 1977 .

Chemical physics of superconductivity in layered yttrium carbide halides from first principles

R. Arita, J. Tse, R. Akashi, 2021, 2103.05312.

Phonon density of states of Fe2O3 across high-pressure structural and electronic transitions

J. Tse, E. Alp, Yuming Xiao, 2011 .

Toward a comprehensive understanding of solid-state core-level XPS linewidths: Experimental and theoretical studies on the Si 2p and O 1s linewidths in silicates

J. Tse, M. Biesinger, H. Nesbitt, 2009 .

Doming modes and dynamics of model heme compounds

J. Tse, R. Hemley, D. Klug, 2002, Proceedings of the National Academy of Sciences of the United States of America.

Phonon-mediated superconductivity in quasi-1D Sc3CoC4

J. Tse, Hai-Qing Lin, Chao Zhang, 2012 .

Mechanism for the Structural Transformation to the Modulated Superconducting Phase of Compressed Hydrogen Sulfide

A. Majumdar, J. Tse, Yansun Yao, 2019, Scientific Reports.

Superconductivity in high-pressure solids

Yanming Ma, J. Tse, Yansun Yao, 2007 .

Superconductivity in simple elemental solids—a computational study of boron-doped diamond and high pressure phases of Li and Si

Yanming Ma, J. Tse, H. Tutuncu, 2005 .

Theoretical investigation of the electronic structure and transport properties of Na1+xCo2O4

J. Tse, D. Klug, Xingtao Gao, 2004 .

X‐ray diffraction and x‐ray absorption studies of porous silicon, siloxene, heat‐treated siloxene, and layered polysilane

B. Way, J. Dahn, J. Tse, 1994 .

Possibility of realizing superionic ice VII in external electric fields of planetary bodies

Niall J. English, J. Tse, Z. Futera, 2020, Science Advances.

Thermodynamic stability of hydrogen clathrates

J. Tse, S. Patchkovskii, 2003, Proceedings of the National Academy of Sciences of the United States of America.

Angle-resolved photoelectron study of the group VIB metal hexacarbonyls M(CO) 6 (M=Cr, Mo, W) from 9 to 30 eV photon energy

James W. Taylor, J. Tse, B. Yates, 1990 .

Photoelectron study of the valence level cross sections of XeF2 above the Xe 4d threshold: many-body effects

J. Tse, B. Yates, S. Aksela, 1987 .

Itinerant ferromagnetic half metallic cobalt–iron couples: promising bifunctional electrocatalysts for ORR and OER

J. Tse, Yongfu Tang, Yufeng Zhao, 2019, Journal of Materials Chemistry A.

The nature of encapsulated silicon nanoclusters in zeolite Y

J. Tse, D. Klug, C. Ratcliffe, 1999 .

Characterization of the location and interfacial states of gallium in gallium/MCM-41 composites

J. Tse, C. Ratcliffe, J. Ripmeester, 2005 .

Density equalisation in supercooled high- and low-density water mixtures.

Niall J. English, J. Tse, N. English, 2013, The Journal of chemical physics.

Iodate in calcite and vaterite: Insights from synchrotron X-ray absorption spectroscopy and first-principles calculations

J. Tse, Yongfeng Hu, N. Chen, 2017 .

The vibrational properties of xenon hydrate: An inelastic incoherent neutron scattering study

C. Gutt, J. Tse, W. Press, 2002 .

Thermal expansion of structure I ethylene oxide hydrate

John S. Tse, Massimo Marchi, J. Tse, 1987 .

Speciation and distribution of copper in a mining soil using multiple synchrotron-based bulk and microscopic techniques

J. Tse, Jian Wang, T. Regier, 2014, Environmental Science and Pollution Research.

Inelastic x-ray scattering of dense solid oxygen: Evidence for intermolecular bonding

H. Mao, J. Tse, J. Shu, 2008, Proceedings of the National Academy of Sciences.

Crystal field splittings of continuum d orbitals. A comparative study on the L2,3 edge X-ray absorption spectra of Si, P and S compounds

J. Tse, G. Bancroft, K. Tan, 1992 .

The d and f resonances in the core level absorption spectra of TeF6

J. Tse, 1989 .

Oxygen K-edge XANES of crystalline and amorphous ice

J. M. Chen, J. Tse, K. Tan, 1990 .

Variable energy photoelectron study of the valence levels of CF3X (X = F, Cl, Br, I) compounds between 21 and 200 eV photon energies

J. Bozek, J. Tse, B. Yates, 1989 .

Comment on "State-dependent electron delocalization dynamics at the solute-solvent interface: soft-x-ray absorption spectroscopy and ab initio calculations".

J. Tse, T. Regier, A. Moewes, 2014, Physical Review Letters.

High-resolution HeI and HeII photoelectron spectra of the zinc and cadmium dihalide valence bands

J. Tse, G. Bancroft, D. J. Bristow, 1983 .

Variable-energy photoelectron study of the valence levels of tetramethylsilane and tetramethylstannane and the tin 4d levels of Sn(CH3)4

J. Tse, G. Bancroft, K. Tan, 1987 .

Experimental and theoretical shakeup studies. VI. The fluoromethanes

J. Tse, G. Bancroft, E. Pellach, 1985 .

Atomically dispersed quintuple nitrogen and oxygen co-coordinated zirconium on graphene-type substrate for highly efficient oxygen reduction reaction

J. Tse, Chenglin Yan, Meng Yang, 2022, Cell Reports Physical Science.

Wave-layered dendrite-free lithium deposition with unprecedented long-term cyclability

J. Tse, D. Liu, Jiawen Feng, 2023, Journal of Power Sources.

Experimental and theoretical shake-up studies. The rare gases

J. Tse, G. Bancroft, D. J. Bristow, 1982 .

Stability of doubly occupied N2 clathrate hydrates investigated by molecular dynamics simulations

J. Tse, D. Klug, J. Michels, 2001 .

Advanced electrocatalysts with Dual-metal doped carbon Materials: Achievements and challenges

J. Tse, Yan Li, Chunxiao Liu, 2022, Chemical Engineering Journal.

First-principles study of liquid gallium at ambient and high pressure.

T. Iitaka, J. Tse, Jianjun Yang, 2011, The Journal of chemical physics.

Temperature-dependent kinetic pathways featuring distinctive thermal-activation mechanisms in structural evolution of ice VII

Wenge Yang, H. Mao, J. Tse, 2020, Proceedings of the National Academy of Sciences.

Kinetically Controlled Two-Step Amorphization and Amorphous-Amorphous Transition in Ice.

Jesse S. Smith, S. Sinogeikin, J. Tse, 2017, Physical Review Letters.

Venture into Water's No Man's Land: Structural Transformations of Solid H_{2}O under Rapid Compression and Decompression.

Jesse S. Smith, Wenge Yang, J. Tse, 2018, Physical review letters.

Temperature- and Rate-Dependent Pathways in Formation of Metastable Silicon Phases under Rapid Decompression.

Jesse S. Smith, Wenge Yang, J. Tse, 2020, Physical review letters.

The mechanisms for pressure-induced amorphization of ice Ih

Y. Kawazoe, I. Swainson, J. Tse, 1999, Nature.

Computational Techniques in the Study of the Properties of Clathrate Hydrates

J. Tse, 2015 .

Intermolecular potentials in gas hydrates

J. Tse, D. Davidson, 2008 .

Dynamical Properties and Stability of Clathrate Hydrates

J. Tse, 1994 .

High-resolution valence-band XPS spectra of the nonconductors quartz and olivine

W. Skinner, J. Tse, H. Nesbitt, 2005 .

Modification of surface chemistry by lattice Sn doping in BiFeO3 nanofibers

J. Tse, M. Sobhan, P. Wu, 2015 .

Vibrational spectrum, elastic moduli and mechanical stability in ice VIII

J. Tse, V. Belosludov, V. Shpakov, 1999 .

Ordering of hydrogen bonds in high-pressure low-temperature H2O.

C. C. Chen, H. Mao, J. Tse, 2005, Physical review letters.

High pressure–low temperature phase diagram of barium: Simplicity versus complexity

Yanming Ma, J. Tse, Y. Ohishi, 2015 .

Theoretical X-ray absorption investigation of the uniaxial compression of hexagonal graphite

J. Tse, M. Odelius, D. M. Shaw, 2007 .

Synthesis of Atomically Thin Hexagonal Diamond with Compression.

Yan-Kai Tzeng, J. Tse, Junqiao Wu, 2020, Nano letters.

An automated predictor for identifying transition states in solids

Jian Lv, Yanchao Wang, Yanming Ma, 2020, npj Computational Materials.

Allium fistulosum as a novel system to investigate mechanisms of freezing resistance.

J. Tse, K. Tanino, M. Uemura, 2013, Physiologia plantarum.

Dynamics and superconductivity in compressed lanthanum superhydride

J. Tse, R. Hemley, Hanyu Liu, 2018, Physical Review B.

Structural and electronic properties of pristine and Ba-doped clathrate-like carbon fullerenes.

T. Iitaka, J. Tse, Jianjun Yang, 2007, Angewandte Chemie.

First-principles study of structural and dynamical properties of As overlayers on InP(110)

G. P. Srivastava, J. Tse, H. M. Tütüncü, 2002 .

SiCl4 desorption in chlorine etching of Si(100) — a first principles study

J. Tse, W. M. Lau, Zhifeng Liu, 1999 .

Structural and dynamical properties of As overlayers on the GaAs(1 1 0) surface

G. P. Srivastava, J. Tse, H. M. Tütüncü, 2003 .

Hard BN Clathrate Superconductors.

J. Tse, Siyu Lu, Hanyu Liu, 2019, The journal of physical chemistry letters.

Superconductivity in dense carbon-based materials

Bai Yang, J. Tse, R. Hemley, 2016 .

Structure and phase stability of binary zintl-phase compounds: lithium-group 13 intermetallics and metal-doped group 14 clathrate compounds.

J. Tse, R. Rousseau, K. Uehara, 2002, Chemistry.

Structure and electronic properties of at high pressure

Jesse S. Smith, J. Tse, D. Klug, 2009 .

Superconductivity in Hydrogen Dominant Materials: Silane

J. S. Tse, M. Eremets, J. Tse, 2008, Science.

Structure and spectroscopic properties of dense solid hydrogen at 160 GPa

J. Rodgers, J. Tse, D. Klug, 2008 .

Novel superconductivity in metallic SnH(4) under high pressure.

K Tanaka, J. Tse, K. Tanaka, 2007, Physical review letters.

Ab initio molecular dynamics study of the pressure-induced phase transformations in cristobalite

J. Tse, D. Klug, R. Rousseau, 2001 .

Carbonate melts under lower mantle conditions.

J. Tse, Min Wu, Yuanming Pan, 2022, Science Bulletin.

X-Ray Diffraction Study of Chrysotile Compressed in Water under High P–T Conditions of up to 8 GPa and 420°С

J. Tse, S. Goryainov, A. Likhacheva, 2019, Bulletin of the Russian Academy of Sciences: Physics.

Structures and Transport Properties of CaCO3 Melts under Earth’s Mantle Conditions

J. Tse, Min Wu, Yuanming Pan, 2017 .

Tetracarbonates in silicate melts may be at the origin of a deep carbon reservoir in the deep Earth

M. Di Michiel, J. Tse, A. Jones, 2023, Communications Earth & Environment.

Identifying the Zn–Co binary as a robust bifunctional electrocatalyst in oxygen reduction and evolution reactions via shifting the apexes of the volcano plot

J. Tse, Yufeng Zhao, Qian Liu, 2021 .

THE ELECTRONIC STRUCTURE OF METALLO-SILICON CLATHRATES NAXSI136 (X=0, 4, 8, 16 AND 24)

J. Tse, V. I. Smelyansky, 1997 .

A clathrate hydrate of carbon monoxide

J. Tse, C. Ratcliffe, J. Ripmeester, 1987, Nature.

EPR studies of the addition of aluminum and gallium atoms to allene: a rule for regioselectivity

J. Tse, B. Mile, J. Howard, 1988 .

Electron spin resonance spectra of the aluminium trimer in hydrocarbon matrices: a quartet 4A2 state

John S. Tse, J. Tse, B. Mile, 1985 .

Bonding in the “111” Type Ferropnictide Superconductor LiFeAs

J. Tse, C. Jin, Zhi Li, 2010 .

Dynamics of Kr in dense clathrate hydrates

J. Tse, D. Klug, E. Alp, 2011 .

Hydrogen-bond dynamics and Fermi resonance in high-pressure methane filled ice.

J. Tse, R. Hemley, D. Klug, 2006, The Journal of chemical physics.

Electronic stucture of methane hydrate studied by Compton scattering

C. Gutt, J. Tse, D. Klug, 2006 .

Lattice distortion of hcp solid helium under pressure

H. Mao, J. Tse, R. Hemley, 2009 .

Raman scattering in hcp rare gas solids under pressure

H. Mao, J. Tse, R. Hemley, 2008 .

X-Ray absorption and photoelectron spectroscopic observation of intrazeolitic silicon nanoclusters

J. Tse, D. Klug, K. F. Preston, 1997 .

Electron density topology of high-pressure Ba 8 Si 46 from a combined Rietveld and maximum-entropy analysis

T. Iitaka, Jianzhong Jiang, J. Tse, 2007 .

High-pressure Raman study of the potassium-doped silicon clathrateK8Si46

J. Tse, S. Sasaki, T. Kume, 2004 .

Structural stability and phase transitions in K8Si46 clathrate under high pressure.

Y. Kawazoe, Zhi-Qiang Li, J. Tse, 2002, Physical review letters.

Phonon Band Structures and Resonant Scattering in Na8Si46 and Cs8Sn46 Clathrates

Zhi-Qiang Li, J. Tse, K. Uehara, 2002 .

Recent Trends for the Design and Optimization of Thermoelectric Materials — A Theoretical Perspective

J. Tse, D. Klug, 2005 .

Multinuclear NMR and Powder X-ray Diffraction Studies of Si and Sn Clathrates of Alkali

J. Tse, I. Moudrakovski, M. Ferguson, 2001 .

Charge transfer in silicon clathrates studied by Compton scattering

J. Tse, P. McMillan, T. Buslaps, 2007 .

Vibrational properties and superconductivity in Ba24Si100

T. Iitaka, J. Tse, K. Parlinski, 2006 .

Anharmonic motions of Kr in the clathrate hydrate

C. Gutt, J. Tse, D. Klug, 2005, Nature materials.

A comparative study on pressure-induced structural transformations in a basaltic glass and melt from Ab initio molecular dynamics calculations

A. Majumdar, J. Tse, Yuanming Pan, 2021, Physics and Chemistry of Minerals.

Mechanisms for thermal conduction in methane hydrate.

Niall J. English, J. Tse, N. English, 2009, Physical review letters.

Theoretical x-ray absorption investigation of high pressure ice and compressed graphite

J. Tse, D. M. Shaw, 2007 .

Utility of High Performance Computing Facilities for the Calculation of the Theoretical X-ray Absorption Spectra of Solids

Dawn M. Shaw, John S. Tse, Michael Odelius, 2007, 21st International Symposium on High Performance Computing Systems and Applications (HPCS'07).

Ab initio calculation of the lithium-tin voltage profile

J. Dahn, J. Tse, J. Hafner, 1998 .

Computational High Pressure Science

J. Tse, 2004 .

Soft X-ray induced photoreduction of organic Cu(II) compounds probed by X-ray absorption near-edge (XANES) spectroscopy.

J. Tse, Jian Wang, T. Regier, 2011, Analytical chemistry.

Guest and host contributions towards thermal conduction in various polymorphs of methane hydrate

Niall J. English, J. Tse, N. English, 2010 .

Thermal conductivity of Xe clathrate hydrate at low temperatures

J. Tse, D. Klug, W. Press, 2006 .

Thermodynamic properties of empty lattices of structure I and structure II clathrate hydrates

J. Tse, Y. P. Handa, 1986 .

The Implementation of the Iterative Diagonalization Scheme and ab initio Molecular Dynamics Simulation with the LAPW Method

J. Tse, K. Uehara, 2000 .

Formation and Decomposition Mechanisms for Clathrate Hydrates

J. Tse, D. Klug, 2002 .

Perspectives on Hydrate Thermal Conductivity

Niall J. English, J. Tse, N. English, 2010 .

Mechanisms for thermal conduction in various polymorphs of methane hydrate

Niall J. English, J. Tse, N. English, 2009 .

The structure and dynamics of doubly occupied Ar hydrate

J. Tse, K. Kawamura, H. Itoh, 2000 .

Crystal structure of a clathrate inclusion compound of hydroquinone and hydrogen sulphide

J. Tse, T. Mak, Ka-Sing Lee, 1976 .

Experimental and theoretical studies on the charge-transfer transition in sulfur dioxide-.beta.-quinol and related compounds

J. Tse, J. Ripmeester, 1983 .

Dynamic properties of the structure II clathrate hydrate of krypton

M. Klein, J. Tse, 1987 .

Crystal structure, CP/MAS xeon-129 and carbon-13 NMR of local ordering in Dianin's compound clathrates.

J. Tse, J. Ripmeester, F. Lee, 1988, Journal of the American Chemical Society.

A computational study on the X-ray absorption spectrum of proton-ordered crystalline ice IX

J. Tse, S. Patchkovskii, D. Courmier, 2010 .

Large amplitude fluxional behaviour of elemental calcium under high pressure

J. S. Tse, S. Desgreniers, Y. Ohishi, 2012, Scientific Reports.

Thermoelectric and electrical transport properties of Mg2Si multi-doped with Sb, Al and Zn

J. Tse, T. Iida, Zhenxian Liu, 2015 .

Local structure and thermoelectric properties of Mg2Si0.977−xGexBi0.023 (0.1 ⩽ x ⩽ 0.4)

J. Tse, G. Botton, Zhenxian Liu, 2015 .

Li ion diffusion mechanisms in LiFePO4: an ab initio molecular dynamics study.

J. Tse, John S Tse, Jianjun Yang, 2011, The journal of physical chemistry. A.

Spin localization, magnetic ordering, and electronic properties of strongly correlated Ln2O3 sesquioxides (Ln=La, Ce, Pr, Nd)

J. Tse, P. Cortona, A. Erba, 2018, Physical Review B.

Ab initio determination of crystal lattice constants and thermal expansion for germanium isotopes

Yanming Ma, J. Tse, 2007 .

Mechanism of chemical reactions between SiO2 and CO2 under mantle conditions

J. Tse, Jiuhua Chen, Xue Yong, 2018 .

High-pressure thermal expansion, bulk modulus, and phonon structure of diamond

Stefano de Gironcoli, S. Baroni, J. Tse, 1999 .

First-principles molecular dynamics simulations of single nitrogen bond structures in a N2H2 system under pressure

J. Tse, Hanyu Liu, Xin Zhong, 2019, Solid State Communications.

A New Allotrope of Nitrogen as High-Energy Density Material.

A. Majumdar, J. Tse, Hanyu Liu, 2016, The journal of physical chemistry. A.

High-Energy Density and Superhard Nitrogen-Rich B-N Compounds.

Yinwei Li, Hanyu Liu, J. Tse, 2015, Physical review letters.

High-energy-density and superhard nitrogen-rich BN compounds

J. Tse, Siyu Lu, Hanyu Liu, 2015 .

Valence charge density of multi-doped Mg2Si thermoelectric materials from maximum entropy method analysis

J. Tse, T. Iida, Min Wu, 2016 .

First-Principles Study on the Mechanisms for H2 Formation in Ammonia Borane at Ambient and High Pressure

J. Tse, Yunfeng Liang, 2012 .

Thermodynamic discontinuity between low-density amorphous ice and supercooled water.

J. Tse, D. Klug, P. Rodger, 2002, Physical review letters.

Crystal, molecular and electronic structure of methyltin triiodide

M. J. Collins, J. Tse, E. Gabe, 1986 .

An ab initio study of 5d noble metal nitrides: OsN2, IrN2, PtN2 and AuN2

Jianzhong Jiang, J. Tse, Wei Chen, 2010 .

Metastable high-pressure single-bonded phases of nitrogen predicted via genetic algorithm

John S. Tse, Yansun Yao, J. Tse, 2008 .

Phonon band structures and resonant scattering in Na8Si46 and Cs8Sn44 clathrates

J. Tse, K. Uehara, Z. Li, 2001 .

Effect of external stress on the patterning of nanostructures: a kinetic Monte Carlo simulation of Ta deposited on anistropically compressed Ta(1 0 0) surfaces

J. Tse, D. Klug, Gwang-Soo Kim, 2004 .

High-Density COHx Network Glass

J. Tse, C. Yoo, Xue Yong, 2020 .

First-Principles Calculation of the Electronic Transport Properties of Metals

J. Tse, K. Uehara, 2000 .

Crystal Structures and Electronic Properties of Xe–Cl Compounds at High Pressure

J. Tse, E. Zurek, Niloofar Zarifi, 2018 .

Mechanisms for Pressure-Induced Isostructural Phase Transitions in EuO.

J. Tse, B. Civalleri, A. Erba, 2021, Physical review letters.

Crystal Structure and Superconductivity of PH3 at High Pressures

J. Tse, Hanyu Liu, I. Naumov, 2016 .

Vibrations of Methane in Structure I Clathrate Hydrate—an ab initio Density Functional Molecular Dynamics Study

J. Tse, 2002 .

Structural morphologies of high-pressure polymorphs of strontium hydrides.

T. Iitaka, Yanchao Wang, Yanming Ma, 2015, Physical chemistry chemical physics : PCCP.

Elastic properties of platinum Rh and Rh3X compounds

J. Rodgers, J. Tse, L. Zhao, 2004 .

Intrinsic hardness of crystalline solids

J. Tse, 2010 .

Dynamical properties of hydrogen sulphide motion in its clathrate hydrate from ab initio and classical isobaric-isothermal molecular dynamics.

J. Tse, N. English, 2011, The journal of physical chemistry. A.

Molecular Dynamics Studies of High Pressure Transformations and Structures

J. Tse, D. Klug, 1999 .

AB INITIO MOLECULAR DYNAMICS STUDY ON THE HYDROLYSIS OF MOLECULAR CHLORINE

J. Tse, C. Siu, Zhifeng Liu, 1999 .

Catalysis of the reaction HCl+HOCl→H2O+Cl2 on an ice surface

J. Tse, C. Siu, Zhifeng Liu, 1999 .

Dihydrogen Bonding in Compressed Ammonia Borane and Its Roles in Structural Stability

J. Tse, Xue Yong, Yansun Yao, 2014 .

High-pressure elastic constants of solid krypton from quasiharmonic lattice-dynamics calculations

J. Tse, V. Belosludov, V. Shpakov, 1998 .

Superconducting high-pressure phase of cesium iodide

Yanming Ma, G. Zou, T. Cui, 2009 .

Synergetic effect of Re and Ru on γ/γ′ interface strengthening of Ni-base single crystal superalloys

J. Tse, L. Zhao, Kuiying Chen, 2003 .

Elastic moduli and instability in molecular crystals

J. Tse, R. Belosludov, V. Belosludov, 1997 .

The electrical conductivity of Al2O3 under shock-compression

J. Tse, W. Nellis, Hanyu Liu, 2015, Scientific Reports.

Molecular dynamics simulation study of the properties of doubly occupied N2 clathrate hydrates

J. Tse, D. Klug, J. Michels, 2001 .

Sector 25 at the APS-U: Two new beamlines for advanced spectroscopy

J. Tse, M. Wilke, S. Petitgirard, 2020 .

Structure and Properties of Dense Silica Glass

J. Tse, Min Wu, Yunfeng Liang, 2012, Scientific Reports.

Ordering of Hydrogen Bonds in High-Pressure Low-Temperature H[subscript 2]O

C. C. Chen, Yanming Ma, H. Mao, 2010 .

A molecular dynamics study of the effect of pressure on the properties of water and ice

M. Klein, J. Tse, 1988 .

Equation of state for diamond in wide ranges of pressure and temperature

J. Tse, W. Holzapfel, 2008 .

Effects of Temperature and Pressure on ZDDP

J. Tse, Zhenxian Liu, Yang Song, 2007 .

Ab initio studies on the vibrational and thermal properties of Al 3 Li

Zhi-Qiang Li, J. Tse, 2000 .

First-principles studies of liquid lithium under pressure

T. Iitaka, J. Tse, Jianjun Yang, 2010, Journal of physics. Condensed matter : an Institute of Physics journal.

Pressure-induced polyamorphism in a main-group metallic glass

Jianzhong Jiang, K. Shimizu, J. Tse, 2016 .

Electron-phonon coupling ofα−Gaboron

Yanming Ma, R. Ahuja, J. Tse, 2004 .

Elastic moduli calculation and instability in structure I methane clathrate hydrate

J. Tse, B. Kvamme, C. Tulk, 1998 .

Mechanical instability in ice Ih. A mechanism for pressure‐induced amorphization

J. Tse, 1992 .

Mechanistic Insights into Bioengineered Antibiofilm Enamel Pellicles

J. Tse, W. Siqueira, D. Moussa, 2023, Journal of dentistry research.

Reply to Datchi et al.: Recovered phase CO2-V at low temperature and a newly predicted 3D-extended CO2 phase

J. Tse, Hanyu Liu, C. Yoo, 2017, Proceedings of the National Academy of Sciences.

Crystal structures and dynamical properties of dense CO2

J. Tse, Hanyu Liu, C. Yoo, 2016, Proceedings of the National Academy of Sciences.

Adsorption sites and rotational tunneling of methyl groups in cubic I methyl fluoride water clathrate.

J. Tse, D. Klug, W. Press, 2005, Physical chemistry chemical physics : PCCP.

Rotational dynamics in methane hydrate

C. Gutt, J. Tse, W. Press, 2002 .

Solid-State Polymerization of CO2 from Catalytic Photoexcitation: An Ab Initio Molecular Dynamics Study

J. Tse, C. Yoo, Xue Yong, 2017 .

Evidence from molecular dynamics simulations for non-metallic behaviour of solid hydrogen above 160 GPa

J. Tse, D. Klug, 1995, Nature.

Phonon instabilities in high-pressure bcc-fcc and the isostructural fcc-fcc phase transitions of Cs

Zhi-Qiang Li, J. Tse, D. Klug, 2000 .

Electronic structure of alkali metal-doped M8Si46 (M=Na, K) clathrates - art. No. 153106

Michael J. Ferguson, J. Tse, M. Geshi, 2002 .

Origin of anisotropy and metallic behavior in delafossite PdCoO 2

K. P. Ong, J. Tse, Jia Zhang, 2010 .

Erratum: Structural Principles and Amorphouslike Thermal Conductivity of Na-Doped Si Clathrates [Phys. Rev. Lett. 85, 114 (2000)]

M. White, J. Tse, R. Rousseau, 2001 .

NMR and X-ray Spectroscopy of Sodium−Silicon Clathrates†

J. Tse, D. Klug, K. Uehara, 2001 .

ANOMALOUS ISOSTRUCTURAL TRANSFORMATION IN ICE VIII

J. Tse, D. Klug, 1998 .

Synthesis and electronic structure characterization of diamane

Bin Chen, H. Mao, J. Tse, 2019, 1902.01570.

Structural dynamics of basaltic melt at mantle conditions with implications for magma oceans and superplumes

T. Iitaka, A. Majumdar, J. Tse, 2020, Nature Communications.

Classical and path-integral molecular-dynamics study on liquid water and ice melting using non-empirical TTM2.1-F model

Niall J. English, J. Tse, N. English, 2019, Molecular Physics.

Alloying effects on sulphur embrittlement of the γ-γ′ interface of nickel-based single-crystal superalloys

J. Tse, L. Zhao, Kuiying Chen, 2003 .

Tetracarbonate melts and the fate of primordial carbon in the deep Earth

J. Tse, A. Jones, I. Collings, 2021 .

Mechanism for the Structural Transformation to the Modulated Superconducting Phase of Compressed Hydrogen Sulfide

A. Majumdar, J. Tse, Yansun Yao, 2019, Scientific Reports.

Modulated Structure Calculated for Superconducting Hydrogen Sulfide.

A. Majumdar, J. Tse, Yansun Yao, 2017, Angewandte Chemie.

Thermal and lattice dynamical properties of Na8Si46 clathrate

M. White, Zhi-Qiang Li, J. Tse, 2001 .

Pressure-induced phase transformations in ice.

Klein, Tse, M. Klein, 1987, Physical review letters.

Massively parallel molecular dynamics simulation of formation of ice-crystallite precursors in supercooled water: incipient-nucleation behavior and role of system size.

J. Tse, N. English, 2015, Physical review. E, Statistical, nonlinear, and soft matter physics.

Comment on "New metallic carbon crystal".

T. Iitaka, J. Tse, D. Klug, 2009, Physical review letters.

Lattice vibrations of ices Ih, VIII, and IX

I. R. Mcdonald, M. Klein, J. Tse, 1984 .

Anomalous bond length behavior and a new solid phase of bromine under pressure

J. Tse, Min Wu, Yuanming Pan, 2016, Scientific Reports.

Mechanical Stability of Gas Hydrates under Pressure

Y. Kawazoe, J. Tse, R. Belosludov, 2000 .

A twist in the tale of the structure of ice

J. Tse, 2019, Nature.

Theoretical and experimental shake-up studies of krypton difluoride, xenon tetrafluoride, and xenon hexafluoride

J. Tse, G. Bancroft, D. J. Bristow, 1983 .

Carbon‐Quantum‐Dots‐Loaded Ruthenium Nanoparticles as an Efficient Electrocatalyst for Hydrogen Production in Alkaline Media

Bai Yang, J. Tse, Siyu Lu, 2018, Advanced materials.

Computer simulations of the dynamics of doubly occupied N2 clathrate hydrates

J. Tse, D. Klug, J. Michels, 2002 .

First-principles molecular simulations of Li diffusion in solid electrolytes Li3PS4

J. Tse, Jianjun Yang, 2015 .

Superconductive sodalite-like clathrate calcium hydride at high pressures

T. Iitaka, Yanming Ma, J. Tse, 2012, Proceedings of the National Academy of Sciences.

Calculation of multiplet structures in shakeup spectra by the Xα method

J. Tse, 1980 .

Pressure-induced intermolecular interactions in crystalline silane-hydrogen.

Toshiaki Iitaka, Wai-Leung Yim, T. Iitaka, 2010, Physical review letters.

Two-dimensional boron-nitrogen-carbon monolayers with tunable direct band gaps.

Yanchao Wang, Yanming Ma, J. Tse, 2015, Nanoscale.

optPBE-vdW Density Functional Theory Study of Liquid Water and Pressure-Induced Structural Evolution in Ice Ih

Niall J. English, J. Tse, Xue Yong, 2017 .

Anomalous transformations in ice VIII

J. Tse, R. Hemley, D. Klug, 2004 .

Calculation of single orbital relaxations accompanying core ionization in the isoelectronic ten electrons hydrides by the Xα–SW method

J. Tse, 1980 .

Crystal Structures of CaB3N3 at High Pressures.

J. Tse, Li Zhu, Hanyu Liu, 2017, Inorganic chemistry.

Low-density superhard materials: computational study of Li-inserted B-substituted closo-carboranes LiBC11 and Li2B2C10

J. Tse, Quan Li, Hanyu Liu, 2016 .

Solid-state chemistry: Boron charged under pressure

J. Tse, 2009, Nature.

Phonons on group-III nitride (110) surfaces

G. P. Srivastava, J. Tse, R. Miotto, 2002 .

Hysteretic spin crossover between a bisdithiazolyl radical and its hypervalent σ-dimer.

L. Downie, J. Tse, R. Secco, 2010, Journal of the American Chemical Society.

Pressure-Induced Changes on The Electronic Structure and Electron Topology in the Direct FCC → SH Transformation of Silicon

J. Tse, Zucheng Li, C. Sternemann, 2014 .

Sensitivity of the Kβ″ X-ray Emission Line to Coordination Changes in GeO2 and TiO2

J. Tse, M. Murakami, S. Petitgirard, 2023, The journal of physical chemistry letters.

Elastic properties of methane hydrate at high pressures

C. Gutt, J. Tse, D. Klug, 2005 .