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EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001

Interatomic potential for Silicon (Si).
Use this Potential

Title
A single sentence description.
Original EDIP potential for elemental silicon.
Description
A short description of the Model describing its key features including for example: type of model (pair potential, 3-body potential, EAM, etc.), modeled species (Ac, Ag, ..., Zr), intended purpose, origin, and so on.
This Model contains parameters for the EDIP three-body bond-order potential for pure silicon, as given in J. F. Justo, M. Z. Bazant, E. Kaxiras, V. V. Bulatov, and S. Yip, Phys. Rev. B 58, 2539 (1998). This is a general purpose potential for studying a wide array of bulk structures and defects in silicon.
Species
The supported atomic species.
Si
Disclaimer
A statement of applicability provided by the contributor, informing users of the intended use of this KIM Item.
None
Contributor Daniel S. Karls
Maintainer Daniel S. Karls
Publication Year 2014
How to Cite Click here to download this citation in BibTeX format.
Funding Not available
Short KIM ID
The unique KIM identifier code.
MO_958932894036_001
Extended KIM ID
The long form of the KIM ID including a human readable prefix (100 characters max), two underscores, and the Short KIM ID. Extended KIM IDs can only contain alpha-numeric characters (letters and digits) and underscores and must begin with a letter.
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001
Citable Link https://openkim.org/cite/MO_958932894036_001
KIM Item Type
Specifies whether this is a Portable Model (software implementation of an interatomic model); Portable Model with parameter file (parameter file to be read in by a Model Driver); Model Driver (software implementation of an interatomic model that reads in parameters).
Portable Model using Model Driver EDIP_BOP_C__MD_506186535567_001
DriverEDIP_BOP_C__MD_506186535567_001
KIM API Version1.6
Previous Version EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_000

Verification Check Dashboard

(Click here to learn more about Verification Checks)

Grade Name Category Brief Description Full Results Aux File(s)
P vc-species-supported-as-stated mandatory
The model supports all species it claims to support; see full description.
Results Files
P vc-periodicity-support mandatory
Periodic boundary conditions are handled correctly; see full description.
Results Files
P vc-permutation-symmetry mandatory
Total energy and forces are unchanged when swapping atoms of the same species; see full description.
Results Files
A vc-forces-numerical-derivative consistency
Forces computed by the model agree with numerical derivatives of the energy; see full description.
Results Files
P vc-dimer-continuity-c1 informational
The energy versus separation relation of a pair of atoms is C1 continuous (i.e. the function and its first derivative are continuous); see full description.
Results Files
P vc-objectivity informational
Total energy is unchanged and forces transform correctly under rigid-body translation and rotation; see full description.
Results Files
P vc-inversion-symmetry informational
Total energy is unchanged and forces change sign when inverting a configuration through the origin; see full description.
Results Files
P vc-memory-leak informational
The model code does not have memory leaks (i.e. it releases all allocated memory at the end); see full description.
Results Files
P vc-thread-safe mandatory
The model returns the same energy and forces when computed in serial and when using parallel threads for a set of configurations. Note that this is not a guarantee of thread safety; see full description.
Results Files

Visualizers (in-page)


BCC Lattice Constant

This bar chart plot shows the mono-atomic body-centered cubic (bcc) lattice constant predicted by the current model (shown in the unique color) compared with the predictions for all other models in the OpenKIM Repository that support the species. The vertical bars show the average and standard deviation (one sigma) bounds for all model predictions. Graphs are generated for each species supported by the model.

(No matching species)

Cohesive Energy Graph

This graph shows the cohesive energy versus volume-per-atom for the current mode for four mono-atomic cubic phases (body-centered cubic (bcc), face-centered cubic (fcc), simple cubic (sc), and diamond). The curve with the lowest minimum is the ground state of the crystal if stable. (The crystal structure is enforced in these calculations, so the phase may not be stable.) Graphs are generated for each species supported by the model.

(No matching species)

Diamond Lattice Constant

This bar chart plot shows the mono-atomic face-centered diamond lattice constant predicted by the current model (shown in the unique color) compared with the predictions for all other models in the OpenKIM Repository that support the species. The vertical bars show the average and standard deviation (one sigma) bounds for all model predictions. Graphs are generated for each species supported by the model.

(No matching species)

FCC Elastic Constants

This bar chart plot shows the mono-atomic face-centered cubic (fcc) elastic constants predicted by the current model (shown in blue) compared with the predictions for all other models in the OpenKIM Repository that support the species. The vertical bars show the average and standard deviation (one sigma) bounds for all model predictions. Graphs are generated for each species supported by the model.

(No matching species)

FCC Lattice Constant

This bar chart plot shows the mono-atomic face-centered cubic (fcc) lattice constant predicted by the current model (shown in red) compared with the predictions for all other models in the OpenKIM Repository that support the species. The vertical bars show the average and standard deviation (one sigma) bounds for all model predictions. Graphs are generated for each species supported by the model.

(No matching species)

FCC Stacking Fault Energies

This bar chart plot shows the intrinsic and extrinsic stacking fault energies as well as the unstable stacking and unstable twinning energies for face-centered cubic (fcc) predicted by the current model (shown in blue) compared with the predictions for all other models in the OpenKIM Repository that support the species. The vertical bars show the average and standard deviation (one sigma) bounds for all model predictions. Graphs are generated for each species supported by the model.

(No matching species)

FCC Surface Energies

This bar chart plot shows the mono-atomic face-centered cubic (fcc) relaxed surface energies predicted by the current model (shown in blue) compared with the predictions for all other models in the OpenKIM Repository that support the species. The vertical bars show the average and standard deviation (one sigma) bounds for all model predictions. Graphs are generated for each species supported by the model.

(No matching species)

SC Lattice Constant

This bar chart plot shows the mono-atomic simple cubic (sc) lattice constant predicted by the current model (shown in the unique color) compared with the predictions for all other models in the OpenKIM Repository that support the species. The vertical bars show the average and standard deviation (one sigma) bounds for all model predictions. Graphs are generated for each species supported by the model.

(No matching species)

Cubic Crystal Basic Properties Table

Species: Si



Tests



Conjugate gradient relaxation of atomic cluster

Creators: Daniel Karls
Contributor: karls
Publication Year: 2016
DOI: https://doi.org/

Given an xyz file corresponding to a finite cluster of atoms, create a LAMMPS
file with the given positions/species and compute the total potential energy
and atomic forces.
Test Test Results Link to Test Results page Benchmark time
Usertime muliplied by the Whetstone Benchmark. This number can be used (approximately) to compare the performance of different models independently of the architecture on which the test was run.

Measured in Millions of Whetstone Instructions (MWI)
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 172
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 138
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 172
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 172
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 172
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 172
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 138
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 379
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
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Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 138
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
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Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
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Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
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Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
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Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
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Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 379
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 172
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 310
Conjugate gradient relaxation of random atomic cluster of Si atoms view 172
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 276
Conjugate gradient relaxation of random atomic cluster of Si atoms view 207
Conjugate gradient relaxation of random atomic cluster of Si atoms view 241
Conjugate gradient relaxation of random atomic cluster of Si atoms view 345
Conjugate gradient relaxation of random atomic cluster of Si atoms