검색결과 : 40건
| No. | Article |
|---|---|
| 1 |
Eight-Dimensional Wave Packet Dynamics Within the Quantum Transition-State Framework: State-to-State Reactive Scattering for H-2 + CH3 reversible arrow H + CH4 Zhao B, Manthe U Journal of Physical Chemistry A, 124(45), 9400, 2020 |
| 2 |
Quasi-bound States of the F center dot CH4 Complex (vol 120, pg 3186, 2016) Schapers D, Manthe U Journal of Physical Chemistry A, 123(11), 2286, 2019 |
| 3 |
A Quasi-Classical Evaluation of the J-Shifting Approximation for the Reactive Cross Sections of F + CHD3 and F + CH4 Ellerbrock R, Manthe U, Palma J Journal of Physical Chemistry A, 123(33), 7237, 2019 |
| 4 |
A Quasiclassical Study of the F(P-2) + CHD3 (nu(1)=0,1) Reactive System on an Accurate Potential Energy Surface Palma J, Manthe U Journal of Physical Chemistry A, 119(50), 12209, 2015 |
| 5 |
Vibrational Dynamics of the CH4 center dot F(-)Complex Wodraszka R, Palma J, Manthe U Journal of Physical Chemistry A, 116(46), 11249, 2012 |
| 6 |
Photodissociation of CH3I: A Full-Dimensional (9D) Quantum Dynamics Study Evenhuis CR, Manthe U Journal of Physical Chemistry A, 115(23), 5992, 2011 |
| 7 |
Full-Dimensional Quantum Reaction Rate Calculations for H + CH4 -> H-2 + CH3 on a Recent Potential Energy Surface Schiffel G, Manthe U, Nyman G Journal of Physical Chemistry A, 114(36), 9617, 2010 |
| 8 |
Comparison of Quantum Dynamics and Quantum Transition State Theory Estimates of the H + CH4 Reaction Rate Andersson S, Nyman G, Arnaldsson A, Manthe U, Jonsson H Journal of Physical Chemistry A, 113(16), 4468, 2009 |
| 9 |
Thermochemistry and accurate quantum reaction rate calculations for H-2/HD/D-2 + CH3 Nyman G, van Harrevelt R, Manthe U Journal of Physical Chemistry A, 111(41), 10331, 2007 |
| 10 |
Predicting catalysis: Understanding ammonia synthesis from first-principles calculations Hellman A, Baerends EJ, Biczysko M, Bligaard T, Christensen CH, Clary DC, Dahl S, van Harrevelt R, Honkala K, Jonsson H, Kroes GJ, Luppi M, Manthe U, Norskov JK, Olsen RA, Rossmeisl J, Skulason E, Tautermann CS, Varandas AJC, Vincent JK Journal of Physical Chemistry B, 110(36), 17719, 2006 |