Lars Ojamäe: search on Z-Library

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51

Short H-bonds and spontaneous self-dissociation in (H[sub 2]O)[sub 20]: Effects of H-bond topology

Kuo, Jer-Lai, Ciobanu, Cristian V., Ojamäe, Lars, Shavitt, Isaiah, Singer, Sherwin J.

Journal:

The Journal of Chemical Physics

Year:

2003

Language:

english

File:

PDF, 681 KB

english, 2003

52

An ab initio study of the OH stretching frequencies in ice II, ice VIII, and ice IX

Knuts, Sören, Ojamäe, Lars, Hermansson, Kersti

Journal:

The Journal of Chemical Physics

Year:

1993

Language:

english

File:

PDF, 1.11 MB

english, 1993

53

Water molecules in different crystal surroundings: Vibrational O–H frequencies from ab initio calculations

Ojamäe, Lars, Hermansson, Kersti

Journal:

The Journal of Chemical Physics

Year:

1992

Language:

english

File:

PDF, 1003 KB

english, 1992

54

Theoretical characterization of divacancies at the surface and in bulk MgO

Ojamäe, Lars, Pisani, Cesare

Journal:

The Journal of Chemical Physics

Year:

1998

Language:

english

File:

PDF, 784 KB

english, 1998

55

Hydrogen bond topology and the ice VII/VIII and Ih/XI proton ordering phase transitions

Knight, Chris, Singer, Sherwin J., Kuo, Jer-Lai, Hirsch, Tomas K., Ojamäe, Lars, Klein, Michael L.

Journal:

Physical Review E

Year:

2006

Language:

english

File:

PDF, 527 KB

english, 2006

56

Mechanical and molecular properties of ice VIII from crystal-orbital ab initio calculations

Ojamäe, Lars, Hermansson, Kersti, Dovesi, Roberto, Roetti, Carla, Saunders, V. R.

Journal:

The Journal of Chemical Physics

Year:

1994

Language:

english

File:

PDF, 1.14 MB

english, 1994

57

Crystalline ice: Amorphous on the surface

Journal:

Nature Materials

Year:

2011

Language:

english

File:

PDF, 372 KB

english, 2011

58

Revisiting the Thermochemical Database of Si-C-H System Related to SiC CVD Modeling

Sukkaew, Pitsiri, Ojamäe, Lars, Danielsson, Örjan, Kordina, Olof, Janzén, Erik

Journal:

Materials Science Forum

Year:

2014

Language:

english

File:

PDF, 407 KB

english, 2014

59

CH-Stretching Vibrational Trends in Natural Gas Hydrates Studied by Quantum-Chemical Computations

Liu, Yuan, Ojamäe, Lars

Journal:

The Journal of Physical Chemistry C

Year:

2015

Language:

english

File:

PDF, 2.07 MB

english, 2015

60

A theoretical study of water equilibria: The cluster distribution versus temperature and pressure for (H[sub 2]O)[sub n], n=1–60, and ice

Lenz, Annika, Ojamäe, Lars

Journal:

The Journal of Chemical Physics

Year:

2009

Language:

english

File:

PDF, 1.40 MB

english, 2009

61

A model for carbon incorporation from trimethyl gallium in chemical vapor deposition of gallium nitride.

Danielsson, Örjan, Li, Xun, Ojamae, Lars, Janzén, Erik, Pedersen, Henrik, Forsberg, Urban

Journal:

Journal of Materials Chemistry C

Year:

2015

Language:

english

File:

PDF, 1.84 MB

english, 2015

62

13 C Chemical Shift in Natural Gas Hydrates from First-Principles Solid-State NMR Calculations

Liu, Yuan, Ojamäe, Lars

Journal:

The Journal of Physical Chemistry C

Year:

2016

Language:

english

File:

PDF, 1.75 MB

english, 2016

63

Full Dimensional Quantum Calculations of Vibrational Energies of H 5 O 2+†

Huang, Xinchuan, Cho, Hyung Min, Carter, Stuart, Ojamäe, Lars, Bowman, Joel M., Singer, Sherwin J.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 262 KB

english, 2003

64

Thermochemical Properties of Halides and Halohydrides of Silicon and Carbon

Sukkaew, Pitsiri, Ojamäe, Lars, Kordina, Olof, Janzén, Erik, Danielsson, Örjan

Journal:

ECS Journal of Solid State Science and Technology

Year:

2016

Language:

english

File:

PDF, 293 KB

english, 2016

65

Raman and IR Spectra of Ice Ih and Ice XI with an Assessment of DFT Methods

Liu, Yuan, Ojamäe, Lars

Journal:

Journal of Physical Chemistry B

Year:

2016

Language:

english

File:

PDF, 1.51 MB

english, 2016

66

Simulations of the thermodynamics and kinetics of NH3 at the RuO2 (110) surface

Erdtman, Edvin, Andersson, Mike, Lloyd Spetz, Anita, Ojamäe, Lars

Journal:

Surface Science

Year:

2017

Language:

english

File:

PDF, 1.56 MB

english, 2017

67

Ab Initio Study of Growth Mechanism of 4H–SiC: Adsorption and Surface Reaction of C 2 H 2 , C 2 H 4 , CH 4 , and CH 3

Sukkaew, Pitsiri, Danielsson, Örjan, Kordina, Olof, Janzén, Erik, Ojamäe, Lars

Journal:

The Journal of Physical Chemistry C

Year:

2017

Language:

english

File:

PDF, 915 KB

english, 2017

68

Growth Mechanism of SiC CVD – Adsorption and Surface Reactions of Active Si Species

Sukkaew, Pitsiri, Kalered, Emil, Janzén, Erik, Kordina, Olof, Danielsson, Orjan, Ojamäe, Lars

Journal:

The Journal of Physical Chemistry C

Year:

2017

Language:

english

File:

PDF, 2.42 MB

english, 2017

69

Growth Mechanism of SiC CVD – Surface Etching by H 2 , H Atoms and HCl

Sukkaew, Pitsiri, Danielsson, Orjan, Ojamäe, Lars

Journal:

Journal of Physical Chemistry A

Year:

2018

Language:

english

File:

PDF, 2.25 MB

english, 2018

70

Clathrate Ice sL: A New Crystalline Phase of Ice with Ultralow Density Predicted by First-principles Phase Diagram Computations

Liu, Yuan, Ojamäe, Lars

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.12 MB

english, 2018

71

Time evolution of the CO 2 hydrogenation to fuels over Cu-Zr-SBA-15 catalysts

Atakan, Aylin, Erdtman, Edvin, Mäkie, Peter, Ojamäe, Lars, Odén, Magnus

Journal:

Journal of Catalysis

Year:

2018

Language:

english

File:

PDF, 2.13 MB

english, 2018

72

From Molecule to Cluster to Bulk: Water OH Vibrations in Different Surroundings

HERMANSSON, KERSTI, OJAMÄE, LARS

Journal:

International Journal of Quantum Chemistry

Year:

1992

File:

PDF, 1.24 MB

1992

73

Nucleation of titanium nanoparticles in an oxygen-starved environment. II: theory

Gunnarsson, Rickard, Brenning, Nils, Ojamäe, Lars, Kalered, Emil, Raadu, Michael Allan, Helmersson, Ulf

Journal:

Journal of Physics D Applied Physics

Year:

2018

Language:

english

File:

PDF, 2.94 MB

english, 2018

74

An ultralow-density porous ice with the largest internal cavity identified in the water phase diagram

Liu, Yuan, Huang, Yingying, Zhu, Chongqin, Li, Hui, Zhao, Jijun, Wang, Lu, Ojamäe, Lars, Francisco, Joseph S., Zeng, Xiao Cheng

Journal:

Proceedings of the National Academy of Sciences

Year:

2019

Language:

english

File:

PDF, 1.77 MB

english, 2019

75

The Endocyclic Carbon Substituent of Guanidinate and Amidinate Precursors Controlling ALD of InN Films

Rouf, Polla, O'Brien, Nathan J., Ronnby, Karl, Samii, Rouzbeh, Ivanov, Ivan G., Ojamäe, Lars, Pedersen, Henrik

Journal:

The Journal of Physical Chemistry C

Year:

2019

Language:

english

File:

PDF, 17.73 MB

english, 2019

76

Unprecedented differences in the diamond nucleation density between carbon- and silicon-faces of 4H-silicon carbides

Wang, Bo, Sukkaew, Pitsiri, Song, Guichen, Rosenkranz, Andreas, Lu, Yunxiang, Nishimura, Kazhihito, Wang, Jia, Lyu, Jilei, Cao, Yang, Yi, Jian, Ojamäe, Lars, Li, He, Jiang, Nan

Journal:

Chinese Chemical Letters

Year:

2019

Language:

english

File:

PDF, 1.39 MB

english, 2019

77

Unprecedented differences in the diamond nucleation density between carbon- and silicon-faces of 4H-silicon carbides

Wang, Bo, Sukkaew, Pitsiri, Song, Guichen, Rosenkranz, Andreas, Lu, Yunxiang, Nishimura, Kazhihito, Wang, Jia, Lyu, Jilei, Cao, Yang, Yi, Jian, Ojamäe, Lars, Li, He, Jiang, Nan

Journal:

Chinese Chemical Letters

Year:

2019

File:

PDF, 1.39 MB

2019

78

In-situ Activation of an Indium(III) Triazenide Precursor for Epitaxial Growth of Indium Nitride by Atomic Layer Deposition

O'Brien, Nathan J., Rouf, Polla, Samii, Rouzbeh, Ronnby, Karl, Buttera, Sydney C., Hsu, Chih-Wei, Ivanov, Ivan G., Kessler, Vadim, OjamÃ¤e, Lars, Pedersen, Henrik

Journal:

Chemistry of Materials

Year:

2020

File:

PDF, 631 KB

2020

79

Reduction of carbon impurities in aluminium nitride from time-resolved chemical vapour deposition using trimethylaluminum

Rouf, Polla, Sukkaew, Pitsiri, OjamÃ¤e, Lars, Pedersen, Henrik

Journal:

The Journal of Physical Chemistry C

Year:

2020

File:

PDF, 1.44 MB

2020

80

Kinetic modeling of ammonia decomposition at chemical vapor deposition conditions

RÃ¶nnby, Karl, Pedersen, Henrik, OjamÃ¤e, Lars

Journal:

Journal of Vacuum Science & Technology A Vacuum Surfaces and Films

Year:

2020

File:

PDF, 1.69 MB

2020

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