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Results 1 to 25 of 231

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Molecular dynamics simulation of processing using AFM pin toolYAN, Y. D; SUN, T; DONG, S et al.Applied surface science. 2006, Vol 252, Num 20, pp 7523-7531, issn 0169-4332, 9 p.Article

Optimization techniques for parallel force-decomposition algorithm in molecular dynamic simulationsJI WU SHU; BING WANG; MIN CHEN et al.Computer physics communications. 2003, Vol 154, Num 2, pp 121-130, issn 0010-4655, 10 p.Article

A cell multipole based domain decomposition algorithm for molecular dynamics simulation of systems of arbitrary shapeLAKSHMINARASIMHULU, Pasupulati; MADURA, Jeffry D.Computer physics communications. 2002, Vol 144, Num 2, pp 141-153, issn 0010-4655Article

Extension to the weighted histogram analysis method : combining umbrella sampling with free energy calculationsSOUAILLE, Marc; ROUX, Benoit.Computer physics communications. 2001, Vol 135, Num 1, pp 40-57, issn 0010-4655Article

Gridless finite-size-particle plasma simulationVLAD, G; BRIGUGLIO, S; FOGACCIA, G et al.Computer physics communications. 2001, Vol 134, Num 1, pp 58-77, issn 0010-4655Article

ZFITTER v.6.21: A semi-analytical program for fermion pair production in e+e- annihilationBARDIN, D; BILENKY, M; CHRISTOVA, P et al.Computer physics communications. 2001, Vol 133, Num 2-3, pp 229-395, issn 0010-4655Article

[SMMP] a modem package for simulation of proteinsEISENMENGER, Frank; HANSMANN, Ulrich H. E; HAYRYAN, Shura et al.Computer physics communications. 2001, Vol 138, Num 2, pp 192-212, issn 0010-4655Article

Effective models for prediction of springback in flangingNAN SONG; DONG QIAN; JIAN CAO et al.Journal of engineering materials and technology. 2001, Vol 123, Num 4, pp 456-461, issn 0094-4289Article

Continuum and atomistic studies of intersonic crack propagationHUAJIAN GAO; YONGGANG HUANG; ABRAHAM, Farid F et al.Journal of the mechanics and physics of solids. 2001, Vol 49, Num 9, pp 2113-2132, issn 0022-5096Conference Paper

Molecular dynamics study of structure formation of a single polymer chain by coolingFUJIWARA, Susumu; SATO, Tetsuya.Computer physics communications. 2001, Vol 142, Num 1-3, pp 123-126, issn 0010-4655Conference Paper

Efficient parallel algorithms and software for compressed octrees with applications to hierarchical methodsHARIHARAN, Bhanu; ALURU, Srinivas.Lecture notes in computer science. 2001, pp 125-136, issn 0302-9743, isbn 3-540-43009-1Conference Paper

Scalable I/O of large-scale molecular dynamics simulations : A data-compression algorithmOMELTCHENKO, A; CAMPBELL, T. J; KALIA, R. K et al.Computer physics communications. 2000, Vol 131, Num 1-2, pp 78-85, issn 0010-4655Article

Atomistic simulation of texture competition during thin film depositionHUANG, Hanchen; GILMER, George H.Journal of computer-aided materials design. 2000, Vol 7, Num 3, pp 203-216, issn 0928-1045Article

Parallel molecular dynamics simulations of alkane/hydroxylated α-aluminum oxide interfacesROY, S; JIN, R. Y; CHAUDHARY, V et al.Computer physics communications. 2000, Vol 128, Num 1-2, pp 210-218, issn 0010-4655Article

NWChem : Exploiting parallelism in molecular simulationsSTRAATSMA, T. P; PHILIPPOPOULOS, M; MCCAMMON, J. A et al.Computer physics communications. 2000, Vol 128, Num 1-2, pp 377-385, issn 0010-4655Article

Lattice-gas model with wetness control for various deformable microstructuresNIIMURA, H.Computer physics communications. 2000, Vol 129, Num 1-3, pp 145-157, issn 0010-4655Conference Paper

New approaches for molecular dynamics simulations with nonholonomic constraintsKUTTEH, R.Computer physics communications. 1999, Vol 119, Num 2-3, pp 159-168, issn 0010-4655Article

Tabulated potentials in molecular dynamics simulationsWOLFF, D; RUDD, W. G.Computer physics communications. 1999, Vol 120, Num 1, pp 20-32, issn 0010-4655Article

Nanoscale etching and indentation of a silicon(001) surface with carbon nanotube tipsDZEGILENKO, F. N; SRIVASTAVA, D; SAINI, S et al.Nanotechnology (Bristol. Print). 1999, Vol 10, Num 3, pp 253-257, issn 0957-4484Conference Paper

Analysis of thin beams, using the meshless local Petrov-Galerkin method, with generalized moving least squares interpolationsATLURI, S. N; CHO, J. Y; KIM, H.-G et al.Computational mechanics. 1999, Vol 24, Num 5, pp 334-347, issn 0178-7675Article

Design sensitivity analysis of hyperelastic structures using a meshless methodGRINDEANU, I; CHANG, K.-H; CHRI, K. K et al.AIAA journal. 1998, Vol 36, Num 4, pp 618-627, issn 0001-1452Article

Modèles à vitesses discrètes pour le calcul d'écoulements hors équilibre cinétique = Discrete-velocity models for kinetic nonequilibrium flowsCHARRIER, P; DUBROCA, B; FEUGEAS, J.-L et al.Comptes rendus de l'Académie des sciences. Série 1, Mathématique. 1998, Vol 326, Num 11, pp 1347-1352, issn 0764-4442Article

Strain localization: Short to long correlation length transitionKRAJCINOVIC, D; VUJOSEVIC, M.International journal of solids and structures. 1998, Vol 35, Num 31-32, pp 4147-4166, issn 0020-7683Article

Are Gauss-Legendre methods useful in molecular dynamics ?LOPEZ-MARCOS, M. A; SANZ-SERNA, J. M; DIAZ, J. C et al.Journal of computational and applied mathematics. 1996, Vol 67, Num 1, pp 173-179, issn 0377-0427Article

Computer simulation of medium-range order in liquid and glassy alloys : finite-size and self-averaging effectsHAFNER, J; BECKER, C.Journal of physics. Condensed matter (Print). 1996, Vol 8, Num 29, pp 5269-5280, issn 0953-8984Article

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