Volume 105; Issue 12

Journal of Physical Chemistry A

Volume 105; Issue 12

1

Classical Fluctuating Charge Theories: The Maximum Entropy Valence Bond Formalism and Relationships to Previous Models †

Morales, Jorge, Martínez, Todd J.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 89 KB

english, 2001

2

Dynamical Aspects of Isomerization and Melting Transitions in [H 2 O] 8†

Laria, Daniel, Rodriguez, Javier, Dellago, Christoph, Chandler, David

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 81 KB

english, 2001

3

Out-of-Plane Modes of cis -1,3,5-Hexatriene: Frequency Shifts in the 2 1 A 1 and 1 1 B 1 Excited States †

Woywod, Clemens, Snyder, James A., Frederick, John H.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 121 KB

english, 2001

4

Toward Polyatomic Wave Packet Decomposition: Final State Effects †

Resch, Kevin, Blanchet, Valérie, Stolow, Albert, Seideman, Tamar

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 306 KB

english, 2001

5

Comparing Models for Diffusion in Supercooled Liquids: The Eutectic Composition of the Ag−Cu Alloy †

Vardeman, Charles F., Gezelter, J. Daniel

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 96 KB

english, 2001

6

Quantum Dynamics of the CH 4 + H → CH 3 + H 2 Reaction: Full-Dimensional and Reduced Dimensionality Rate Constant Calculations †

Huarte-Larrañaga, Fermín, Manthe, Uwe

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 95 KB

english, 2001

7

Model Study of the Acid−Base Proton-Transfer Reaction of the ClH···OH 2 Pair in Low-Polarity Solvents †

Thompson, Ward H., Hynes, James T.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 146 KB

english, 2001

8

A Theoretical Study on Chirped Coherent Raman Spectroscopy †

Mishima, Kenji, Yamashita, Koichi

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 168 KB

english, 2001

9

Nearside−Farside Analysis of Differential Cross Sections: Ar + HF Rotationally Inelastic Scattering †

Whiteley, T. W. J., Noli, C., Connor, J. N. L.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 171 KB

english, 2001

10

Complete Electron Nuclear Dynamics

Deumens, Erik, Öhrn, Yngve

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 79 KB

english, 2001

11

Semiclassical Dynamics in the Coherent Control of Nonadiabatic ICN Photodissociation †

Batista, Victor S., Brumer, Paul

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 125 KB

english, 2001

12

Tribute to William H. Miller †

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 53 KB

english, 2001

13

Highly Excited Bound and Low-Lying Resonance States of H 2 O †

Gray, Stephen K., Goldfield, Evelyn M.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 122 KB

english, 2001

14

Correlation Functions and Thermal Rate Constants †

Karlsson, Hans O., Goscinski, Osvaldo

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 55 KB

english, 2001

15

Interlocking Triplet Electronic States of Isocyanic Acid: Sources of Nonadiabatic Photofragmentation Dynamics †

Valeev, Edward F., Allen, Wesley D., Schaefer, Henry F., Császár, Attila G., East, Allan L. L.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 166 KB

english, 2001

16

IVR Formulation of Miller's Correspondence Relations †

Kay, Kenneth G.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 127 KB

english, 2001

17

Application of Semirigid Vibrating Rotor Target Model to the Reaction of O( 3 P) + CH 4 → CH 3 + OH †

Wang, Ming-Liang, Li, Yi-Min, Zhang, John Z. H.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 72 KB

english, 2001

18

Brief Comments on Perturbation Theory of a Nonsymmetric Matrix: The GF Matrix †

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 50 KB

english, 2001

19

Fingerprints of a Classical Resonance on the Eigenlevel Dynamics of the Corresponding Quantum Hamiltonian †

Keshavamurthy, Srihari

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 260 KB

english, 2001

20

Electron−Nuclear Coupling in the Classical Limit for the Electronic Degrees of Freedom †

Remacle, F., Levine, R. D.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 135 KB

english, 2001

21

A Hamiltonian with a Subset of Normal Modes for Studying Mode-Specific Energy Transfer in Intermolecular Collisions †

Yan, Tianying, Hase, William L.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 137 KB

english, 2001

22

Reactive and Nonreactive Quenching of OH(A 2 Σ + ) in Collisions with H Atoms †

Schatz, George C., Fisher, Brent, Grande, Will, Kumayama, Ken, Pederson, Lisa A.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 141 KB

english, 2001

23

William Hughes Miller Biographical Notes

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 6 KB

english, 2001

24

State-to-State Reactive Scattering via Real L 2 Wave Packet Propagation for Reduced Dimensionality AB + CD Reactions †

Skokov, Sergei, Bowman, Joel M.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 84 KB

english, 2001

25

Semiclassical Theory for Tunneling of Electrons Interacting with Media †

Burin, Alexander L., Berlin, Yuri A., Ratner, Mark A.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 89 KB

english, 2001

26

A Multi-State Empirical Valence Bond Model for Weak Acid Dissociation in Aqueous Solution †

Čuma, Martin, Schmitt, Udo W., Voth, Gregory A.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 188 KB

english, 2001

27

Symmetry Friend or Foe: Confluences of Conical Intersection Seams in Tetra-Atomic Molecules †

Yarkony, David R.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 65 KB

english, 2001

28

Direct and Chaotic Ionization in the Presence of External Fields: the Transition-State Theory Point of View †

Jaffé, Charles, Uzer, T.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 150 KB

english, 2001

29

Scaling Rules for Resonance Dynamics near a Saddle Point: The Pendulum as a Zero-Order Model †

Jacobson, Matthew P., Child, Mark S.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 85 KB

english, 2001

30

The Utility of Constraining Basis Function Indices When Using the Lanczos Algorithm to Calculate Vibrational Energy Levels †

Wang, Xiao-Gang, Carrington, Tucker

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 68 KB

english, 2001

31

Quantum Rate Constants from Short-Time Dynamics: An Analytic Continuation Approach †

Sim, Eunji, Krilov, Goran, Berne, B. J.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 94 KB

english, 2001

32

Autobiographical Sketch of William Hughes Miller †

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 21 KB

english, 2001

33

Quantum and Classical Connections and Topological Phases: A Study of a Perturbed Rotator †

Baer, Michael, Billing, Gert D.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 82 KB

english, 2001

34

Explosive Boiling of Water Films Adjacent to Heated Surfaces: A Microscopic Description †

Dou, Yusheng, Zhigilei, Leonid V., Winograd, Nicholas, Garrison, Barbara J.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 1.19 MB

english, 2001

35

Predominance of Nonequilibrium Dynamics in the Photodissociation of Ketene in the Triplet State †

Kaledin, Alexey L., Seong, Jeonghee, Morokuma, Keiji

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 151 KB

english, 2001

36

William H. Miller Research Group and Alumni †

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 6 KB

english, 2001

37

A Relationship between Electron-Transfer Rates and Molecular Conduction †

Nitzan, Abraham

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 35 KB

english, 2001

38

Theoretical Description of Secondary Emission Reflecting Ultrafast Nonadiabatic Isomerization †

Hahn, Susanne, Stock, Gerhard

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 116 KB

english, 2001

39

Photodissociation Dynamics of Molecular Fluorine in an Argon Matrix Induced by Ultrashort Laser Pulses †

Chaban, Galina, Gerber, R. Benny, Korolkov, Mikhail V., Manz, Jörn, Niv, Masha Y., Schmidt, Burkhard

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 302 KB

english, 2001

40

Quantum-Classical Dynamics in a Classical Bath †

Kapral, Raymond

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 54 KB

english, 2001

41

An Eikonal Treatment of Electronically Diabatic Photodissociation: Branching Ratios of CH 3 I †

Micha, David A., Stodden, Clifford D.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 79 KB

english, 2001

42

A Quantum Study on the Reaction between C( 3 P) and Acetylene †

Buonomo, Erasmo, Clary, David C.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 250 KB

english, 2001

43

Absorption and Fluorescence Excitation Spectra of 9-( N -carbazolyl)-anthracene: Effects of Intramolecular Vibrational Redistribution and Diabatic Transitions Involving Electron Transfer †

Evers, F., Giraud-Girard, J., Grimme, S., Manz, J., Monte, C., Oppel, M., Rettig, W., Saalfrank, P., Zimmermann, P.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 206 KB

english, 2001

44

Modeling Proton Mobility in Acidic Zeolite Clusters. 3. A Sudden Approximation via Semiclassical Rate Theory †

Fermann, Justin T., Auerbach, Scott M.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 87 KB

english, 2001

45

Classical Trajectory Study of Energy Transfer in Pyrazine−CO Collisions †

Higgins, Cortney, Ju, Quan, Seiser, Natalie, Flynn, George W., Chapman, Sally

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 126 KB

english, 2001

46

The Regularized Resolvent Transform for Quantum Dynamics Calculations †,‡

Mandelshtam, Vladimir A.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 58 KB

english, 2001

47

On the Origin of Pulse Shaping Control of Molecular Dynamics †

Shapiro, Moshe, Brumer, Paul

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 59 KB

english, 2001

48

Infrared Multiphoton Dissociation of Acetone in a Molecular Beam †

Berrie, Cindy L., Longfellow, Cheryl A., Suits, Arthur G., Lee, Yuan T.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 85 KB

english, 2001

49

On the Effect of Initial Rotation on Reactivity. A Multi-Configuration Time-Dependent Hartree (MCTDH) Wave Packet Propagation Study on the H + D 2 and D + H 2 Reactive Scattering Systems †

Sukiasyan, S., Meyer, H.-D.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 177 KB

english, 2001

50

Time-Dependent Reactive Scattering of the H - + H 2 ↔ H 2 + H - System †

Jaquet, Ralph, Heinen, Martin

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 491 KB

english, 2001

51

Semiclassical Quantization Using Invariant Tori: A Gradient-Descent Approach †

Tannenbaum, Emmanuel, Heller, Eric J.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 110 KB

english, 2001

52

Nonequilibrium Solvation and the Quantum Kramers Problem: Proton Transfer in Aqueous Glycine †

Karmacharya, Rakesh, Antoniou, Dimitri, Schwartz, Steven D.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 55 KB

english, 2001

53

Fast Numerical Integrator for Stochastic Differential Equations with Nonstationary Multiplicative Noise †

Hershkovitz, Eli, Hernandez, Rigoberto

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 79 KB

english, 2001

54

Finite Temperature Correlation Functions via Forward−Backward Semiclassical Dynamics †

Jezek, Eric, Makri, Nancy

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 78 KB

english, 2001

55

Rotational Relaxation in a Nondipolar Supercritical Fluid: Toluene in CO 2†

Siavosh-Haghighi, Ali, Adams, John E.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 139 KB

english, 2001

56

Mean-Field Molecular Dynamics with Surface Hopping: Application to the Aqueous Solvated Electron †

Wong, Kim F., Rossky, Peter J.

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 199 KB

english, 2001

57

Publications of William H. Miller †

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 68 KB

english, 2001

To build up a library is to create a life. It’s never just a random collection of books.

— Carlos María Domínguez

Official channel

Z-Library Desktop Launcher

Tor version

Z-Library

Z-Library Since 2009 support@1delivery.pm

EnglishРусскийEspañolItalianoελληνικάاللغة العربيةBahasa IndonesiaBahasa Malaysiaहिन्दीDeutschFrançaisPortuguêsУкраїнськаPolski中文繁體中文日本語Tiếng ViệtAzərbaycan DiliՀայոց լեզուภาษาไทยTürk Diliქართველიবাংলাپښتوతెలుగుاردو한국어SrpskiБългарски